MECHANICAL AND INDUSTRIAL ENGINEERING

A. L. ADDY, Head
A. M. CLAUSING and H. SEHITOGLU, Associate Heads
144 Mechanical Engineering Building, 1206 W. Green St.,
Urbana, IL 61801-2978 - 217-333-1176


The mission of the Department of Mechanical and Industrial Engineering is to meet the needs of our profession and society with distinction and integrity through education, research, and service; to educate engineers who will become leaders in their fields; to generate new knowledge that will strengthen the engineering profession and respond to societal needs; and to foster effective professional and public service.

Research in the department is broadly based, following the traditional disciplines of mechanical engineering and industrial engineering on the one hand and exploring emerging areas on the other. These research directions reflect the interests and creativity of the faculty and students. Education of new generations of researchers is integral to the department's research mission.

While the generation of new knowledge remains central, the application of new knowledge and technology transfer are also driving factors in the department's research commitments. The faculty is deeply concerned with meeting the needs of the state of Illinois and the nation.

The department is committed to expanding its cooperative research with state and federal government agencies and, especially, its outreach to industry. Several departmental industry-driven initiatives focus on research and technology transfer: the Manufacturing Research Center; the Institute for Competitive Manufacturing; the Machine Tool Agile Manufacturing Research Institute; and two National Science Foundation industry/university cooperative centers, the Air Conditioning and Refrigeration Center and the Center for Machine-Tool Systems Research.

The department is strongly committed to cross-disciplinary research and works closely with other departments across the College of Engineering. The Beckman Institute for Advanced Science and Technology, the National Center for Supercomputing Applications, the Materials Research Laboratory, and other campus resources add strength and diversity to the department's research.

Much of the department's research involves investigation of the production, conversion, utilization, and conservation of energy along with environmental impact; the problems of creating safer, more efficient, and more cost-effective raw materials, products, and services; and the dynamics of man-machine systems. Area of focus are described on the following pages.



BIOCERAMICS





We are attempting to generate microstructures for an artificial bone from composite particles produced by a method developed in our laboratory (hydroxyapatite-polypeptide composites). An important consideration is the surgical delivery of this material as a deformable mass which hardens within minutes and then integrates with natural bone by partial biodegradation. We have recently demonstrated that microstructures partly sintered under high pressure can harden significantly after exposure to laser beams in the visible range. The molecular mechanism is thought to involve the simultaneous polymerization and ionic gelation of two oppositely charged macromolecules.



CEMENTITIOUS MATERIALS





Macro-defect-free (MDF) cement pastes are being studied with the following objectives: (1) optimizing processing parameters, (2) improving resistance to moisture, and (3) developing alternative cement-polymer composites. Flexural strengths up to 300 MPa are achieved in the dry state, with a 0-20% decrease in strength occurring after immersion in water.




This research focuses on understanding the role of polyelectrolytes (commonly referred to as superplasticizers) on the rheological behavior and dispersion of cement-based dispersions. Model cement powders, beta- and gamma-C2S, have been synthesized for this study. The influence of several acrylate-based polyelectrolytes, obtained commercially, with varying molecular weight, branch lengths, and ionizable side groups have been studied. Experimental observations will be compared to their theoretically predicted stabilization behavior to elucidate the mechanisms by which stability is imparted by this important new class of superplasticizers.




This project investigates the development of new materials we have termed "organoceramics," which are based on the concept of inorganic crystal growth in the presence of polymers and/or monomers. The products of interest are inorganic-organic intercalated structures in which polymers and/or monomers may participate in setting reactions. We have been able to synthesize a number of organocalcium aluminate structures containing poly(alcohols) and cationic polyelectrolytes. Interestingly, we find that the intercalated polymers can modulate the crystal structure, crystal habit, and chemical composition of these cementitious materials.




Studies of the electric-field dependence of the shape of cement-based materials are being made using interferometric and strain-gauge techniques. These investigations have already revealed the presence of large unexpected electrically induced strains. Studies as a function of composition, pore parameters, water content, and ion content are being systematically performed. It is hoped that these investigations will reveal for the first time the nature of the complex nonlinear electrical, electromechanical, and mechanical properties of cement materials.




Structural studies of the calcium silicate hydrate gel phase of ordinary portland cement are being performed by transmission electron microscopy, high-resolution transmission electron microscopy, and micromechanical methods. These investigations have already revealed the presence of a mesostructure in calcium silicate hydrate gels for the first time. The nature of this mesostructure is currently being studied as a function of composition, heat treatment, and moisture history. It is hoped that these investigations might lead to a more comprehensive understanding of the complex structure property relationships in cement-based materials.




Strong, dense materials are formed by casting mixtures of calcium silicate (portland) cement and silica fume at very low water contents. The chemistry of the cementitious reactions and development of microstructure are being studied using small-angle x-ray scattering, trimethylsilylation, and thermal analysis. Improvements in processing and particle packing are also under investigation.




The interactions between superplasticizing admixtures with portland cement are being studied. Zeta potential measurements will be combined with rheological behavior to determine the mechanism of dispersion.




Low-porosity concretes are being evaluated for use as overlays on existing airport pavements. These materials use high additions of silica fume and superplasticizers to provide dense concretes of low permeability, good bonding characteristics, and improved wear resistance. However, cracking caused by thermal and drying shrinkage is a concern. This project examines experimentally the properties of these concretes and models their cracking tendencies. Development of bond with the existing pavement will also be considered.




Deterioration of repair mortars underneath fiberglass exterior wraps has been observed in some bridge columns. The cause of this deterioration is under investigation.




Wasteforms based on a magnesium potassium phosphate binder are being characterized using x-ray diffraction, mercury intrusion porosimetry, scanning electron microscopy, and thermal analysis. Model wastes are Class F and Class C fly ashes and a surrogate waste representing plutonium-processing wastes at Rocky Flats. The presence of the wastes influences the physical characteristics of the binding phase, which is MgKPO4·6H2O.



CERAMIC COATINGS





The first part of the program involves the synthesis of ceramic precursors via a chemical synthesis route. The precursors will be characterized using standard procedures such as IR- and NMR- spectroscopy, phase (XRD), and thermal analysis (DTA/TGA). Solutions of the precursors will then be spray deposited onto fibers, single and woven sheet, through a technique called charged liquid beam cluster deposition to form a coating layer. Adhesion of the ceramic coating layer onto fibers and the homogeneity of its distribution will be studied primarily through SEM. Determination of the optimum coating thickness for useful transformation-weakening applications leading to fiber/matrix debonding will follow.



CERAMIC CORROSION





This project involves understanding the effect of corrosion scales on water quality. The cast iron and steel pipes from the Northern Illinois Water Corporation as well as pipes from on-campus locations have been assembled into a Pilot Corrosion Tester system. Corrosion scale analysis is performed using SEM, EDAX, and the x-ray diffraction techniques. Both surface and cross-sectional analyses are done on the scales which are first dried and then removed from the pipe surface. The quantitative and qualitative elemental and the phase composition information obtained is then interfaced with the results from the iron uptake studies carried out at the pilot testing experiment in an effort to understand the underlying mechanisms.



CERAMIC AND GLASSY SOLIDS





Novel glassy materials are needed for photonics applications. Glass formation has conveniently been attributed to a kinetic arrest in structural relaxation, before crystallization can occur. There is, however, increasing evidence for irreversible transitions in the molecular configurations to take place. The decisive processes which need to be understood occur on the time scale of nanoseconds, whether the origin of glass formation is purely kinetic or involves structural phase transitions. This time regime has so far been little investigated. We use Brillouin light scattering to observe structural dynamics in supercooled liquids. This allows us to determine directly the coefficients of momentum transport on the molecular scale, as well as to monitor the structural assembly upon cooling.




Kinetics and mechanisms of fluid-assisted cracking are examined in Si3N4 and Al2O3 ceramics to elucidate the synergistic effect of stress and surface chemistry on microfracture. Three different techniques are being used to measure this effect: the repeated indentation technique, which follows the development of indentation cracks leading to surface microfracture, small crack experiments where the growth of penny- shaped surface cracks is monitored, and fracture mechanics technique with through-thickness cracks. Possible influences of fluid viscosity, temperature, grain size, grain boundary phase, and loading rate on cracking kinetics are investigated.



CERAMIC SYNTHESIS AND PROCESSING





C in a tube furnace under Ar atmosphere, a pure powder is obtained. Crystallinity is examined by XRD analysis and the decomposition behavior of the powder precursor is investigated by thermogravimetric (TGA) and differential thermal analysis (DTA). For characterization of powder synthesized, Fourier transform infrared spectroscopy (FTIR), Auger electron spectroscopy (AES), particle size distribution, specific surface area, chemical analysis, and density measurement are carried out.




C for times of 72 h. A volume contraction of 5.6% is accompanied by the reconstructive transformation.




Fine, pure, high specific area surface powders of dicalcium and tricalcium silicates will be chemically synthesized using an organic- inorganic precursor route. Polyvinyl alcohol is used to chemically bind and sterically entrap component cations in aqueous solution to produce highly reactive submicron powders. They will be characterized in terms of crystallinity, specific surface area, particle size and size distribution, as well as minimum calcination temperature. Composites will be made using aqueous chemical bonding products at low temperatures to incorporate alumina platelets and other filler phases. The relevant mechanical or electrical properties will be measured.



COMPOSITES





Boron carbide-titanium diboride composites are fabricated by reactively sintering boron carbide with titanium in the hot-press. Sintering behavior and microstructural development of the composites are being studied by analytical and high-resolution transmission electron microscopy. Kinetics of the phase formation is being investigated by interrupted growth studies at a wide temperature range. Fracture toughness data are correlated with microstructure and phase composition.




Our objective in this project is to identify oxidation modes of nonoxide particles or fibers that are embedded in a ceramic matrix and determine the dependence of such modes on the composition and microstructure of the matrix. A model is being developed, based on oxygen diffusion rates in matrix and in oxidation products. Experimental measurements (by TEM) of oxide thickness around particle vs. depth of particle below composite surface can be predicted by the model. The matrix can be modified to control oxidation behavior of the embedded reinforcements.




Ceramic matrix composites based on several different oxide matrix materials and reinforced with silicon carbide platelets are prepared by sintering and hot-pressing techniques in an effort to obtain strong, tough, and dense materials. Densification behavior of mullite, alumina, and other matrices is examined. Fracture toughness and strength are measured and related to the microstructure, particularly the interface characteristics.




C. The effect of BN crystallinity on the possible formation of compounds and graphitic solid solutions is investigated by high- resolution transmission electron microscopy.



COMPUTER SIMULATIONS OF MATERIALS





This research focuses on applying high-performance computing to simulate the dynamics of interface motion in complex microstructures and thin-film systems. The approach is based on both sharp interface and diffuse interface theories, and allows one to track interface motion readily. A number of thermodynamic driving forces for energy dissipation, as well as several kinetic mechanisms by which dissipation occurs, have been included. A diverse set of phenomena can be studied with this model, and it is currently being used to examine the growth and coalescence of thin-film islands, Ostwald ripening of precipitates, and the distribution of absorbed liquid in porous networks.




Computer simulations of time-dependent processes can be written using discrete systems of lattice sites whose values are synchronously updated in discrete time steps as a result of local interactions with other sites. We are developing cellular automata programs of a wide variety of physical, chemical, biological, and social phenomena.




Within a Green's function formalism, electronic density-functional theory (DFT) techniques are used to investigate disordered, partially ordered, and fully ordered phases of multicomponent alloy systems. The underlying electronic origin of various materials properties (electronic, magnetic, thermodynamic, elastic) are then determined. Additional schemes are being developed to investigate larger-scale phenomena, such as microstructure and kinetics, which are ultimately based on such DFT results, thus allowing a connection of length scales: micro- to macroscale.




We developed algorithms for large-scale molecular dynamic simulations using massively parallel computing environments, allowing us to study ensembles up to millions of atoms. This gives us the opportunity to tackle the long-standing questions of structural characterization beyond nearest neighbors in amorphous materials. New analytical concepts are being developed allowing one to analyze large molecular configurations for topological patterns as well as structural and chemical heterogeneities.




By using concepts from chaos theory, such as Lyapunov exponents and Kolmogorov-Sinai entropies, we characterize the dynamic behavior of large molecular configurations generated by molecular dynamic simulations. From these measures one can derive conclusions about the thermodynamic stability of a structure, as well as estimate the magnitudes of atomic transport coefficients. The goal of this project is to develop formalisms that allow one to relate the topology of a structure to the inherent mobility of its constituents, and with this knowledge improve the design of electrolytes used in batteries, fuel cells, and sensors.




This research focuses on modeling the removal of volatile species from particulate ceramic films during drying. Specifically, 2-D and 3-D cellular automata models have been developed that contain both random walk and invasion percolation algorithms. These models are being used to determine the removal kinetics, effective diffusivities, and geometry of the developing pore front as a function of relative volatility and composition of the multicomponent fluid, volatile to particle size ratio, and particle size distribution and loading.



ELECTRICAL CERAMICS





This work encompasses the fabrication and characterization of ferroelectric Pb(Sc0.5Ta0.5)O3(PST) thin films by metal-organic chemical vapor deposition (MOCVD) techniques. For infrared detector applications, we perform noise, blackbody responsivity, and spectral response and frequency response measurements. The PST detectors' performance will be compared with commercial state-of-the-art pyroelectric detectors. The ultimate goal of this work is to develop a room-temperature infrared radiation detector. We base our work on the ferroelectric PST system and a novel detection approach which utilizes both the ferroelectric and the pyroelectric properties of PST. We also fabricate other perovskite thin films such as PT, PZT, and BST on various types of substrates and investigate the structure-property- processing relationships.




The primary objective of this research is to produce oxide thin films for sensor applications. One is a flammable gas sensor using SnO2 and the other is a heavy-metal detection sensor in drinking water using Pb-Ag oxide. These oxide thin films are grown by the MOCVD technique. Microstructural analysis is also carried out on the grown films using XRD, SEM, TEM, AES, and XPS. Sensing tests are done for SnO2 using resistivity measurements with reducing gases such as H2, alcohol, etc. Whereas for heavy-metal sensors, tests are done using electrolyte methods in collaboration with Motorola. Models are suggested to explain the measured sensing properties.




Composites consisting of organic polymers and inorganic glassy phases are developed for use as electrolyte materials. The organic polymer contains the charge-carrying species and acts as the conducting phase, whereas the inorganic glass provides mechanical stability. High ionic conductivities can be achieved with this constellation because the conducting phase can be maintained above the glass transition temperature. The electrolytes are synthesized via a sol-gel process. This project is concerned with controlling the structure at the nanoscale to optimize component performance. The electrolytes synthesized in the laboratory are characterized using impedance spectroscopy, small-angle x-ray scattering, and thermal analysis.




Solid-state nonlinear optic and electrooptic devices offer many advantages, including speed, compactness, simplicity, and reliability. Ferroelectric crystals show the strongest nonlinear properties and have high optical damage thresholds. The research is directed at the growth of high-quality single crystals of SrxBa1-xNb2O6 and BaTiO3. Mechanisms of crystal growth are determined. Methods to control the ferroelectric domains are developed. Electrical and optical properties are investigated using structure-property and processing-property relationships for nonlinear optical and electrooptic ceramics. Understanding of the role of dopants is pursued with regard to holographic storage, laser host, and ferroelectric switching applications.




Lead zirconate titanate (PZT) perovskite materials are of considerable technological importance, particularly with regard to physical properties such as pyro- and piezoelectricity and electric field- induced antiferroelectric-to-ferroelectric phase switching. A systematic study of the effects of temperature, Sn- and La- substituents, and Zr/Ti ratio on the evolution of incommensurate phases in high Zr-content PZT is carried out by hot- and cold-stage TEM. Particular attention is paid to the possible development of 1/x[110] incommensurate modulations and to the resul-tant influence on the macroscopic properties. The pur-pose of this investigation is to obtain a fundamental understanding of microstructure-property relationships for electroceramics.




Rare earth manganese perovskites doped with divalent cations, such as Ca, Sr, Ba, and Pb, have been shown to exhibit greatly enhanced magnetoresistive properties when compared with metallic heterolayers. Improved magnetoresistive behavior is greatly desired for sensor applications, such as magnetic read heads, or advanced computer memories, such as MRAM cells. Current research is concerned with the electronic behavior and morphological characterization of doped rare earth manganese perovskite single crystals. Resulting candidate materials were deposited by low-temperature solution processing and self-assembled patterning to form integtated structures for devices.




Sol-gel-derived PZT thin layers deposited on silicon were examined for their shrinkage behavior using in situ ellipsometry. Correlating densification data with thermal analysis (DTA, TGA), the effect of pyrolysis and crystallization on layer shrinkage is observed as experimental parameters such as water of hydrolysis, heating rate, and layer thickness are systematically varied. The resulting stresses in the coating are measured as a function of heat treatment by a laser reflectance technique and related to associated densification phenomena and substrate/layer thermal expansion mismatch.




Thin-layer ceramics have diverse applications as integrated capacitors, sensors, display components, and other devices. Solution processing allows deposition of such layers at greatly reduced temperatures on metal, oxide, and semiconducting substrates with control of stoichiometry, doping level, and crystalline order. Current research is directed at a new selective deposition technique made possible by functionalization of substrates with self-assembled layers. Derivitization of metal, oxide, and semiconductor substrates with hydrophilic or hydrophobic assembled layers enables preferential wetting of surfaces by solution or vapor deposition techniques. Lithography-free selective deposition of ceramic thin layers has been demonstrated.




Recently, bismuth-layered compounds, such as SrBi2Ta2O9 and SrBi2Nb2O9, have been recognized as potential candidates for nonvolatile ferroelectric memory applications. However, their basic structures and intrinsic properties are not well understood. This research is directed at the growth of sizable single crystrals of SrBi2Ta2O9, SrBi2Nb2O9 materials. Several crystal growth techniques, such as Czochralski, top-seeded solution growth, and hydrothermal, are under investigation. Their structures and ferroelectric and optical properties will be determined.




The complex piezoelectric properties of lead zirconate titanate based ceramics are being studied. Investigations are being performed using a modified Michelson-Morely interferometer, which can measure both the real and phase components of the response as a function of temperature and frequency. Investigations are being performed for various ac drive amplitudes and dc bias levels. It is anticipated that these studies will lead to a more comprehensive understanding of the fundamental electromechanical coupling mechanism in ferroelectrics.




The microstructure property relationships in various ferroelectric and piezoelectric ceramics are being studied by transmission electron microscopy. Investigations of the phase transformational characteristics are being performed in situ by hot- and cold-stage methods. Corresponding bulk property investigations are also being performed. Compositional systems currently being investigated include lead zirconate titanate (PZT), La-modified PZT, lead magnesium niobate, strontium barium niobate, and Sn-modified PZT. It is anticipated that these studies may lead to a more comprehensive understanding of the influence of impurities on ferroelectric and antiferroelectric domain structures and phase transformational characteristics.




The dielectric, piezoelectric, and electrically induced strain and polarization characteristics of antiferroelectric Sn-modified lead zirconate titanate ceramics are currently being investigated. Corresponding transmission electron microscopy studies are also being performed. These investigations are revealing the nature of the complex structure property relationships in these materials for the first time. An unusual incommensurately modulated polar structure has been observed. Changes in the modulated structure are being correlated with changes in the macroscopic response characteristics. Evidence is indicating that the nonlinear response is controlled by the modulation of the incommensurate structure by an applied electrical field.




The dependence of the dielectric response characteristics of ferroelectric, soft ferroelectric, and relaxor ferroelectric materials is being studied as a function of ac drive amplitude. Investigations are being performed as a function of temperature, frequency, and superimposed dc bias. These investigations have already revealed the presence of strong nonlinearities in critical compositional regions. The mechanisms underlying the anomalous nonlinearities are currently being studied and related to microstructural changes by transmission electron microscopy.




Studies of lead magnesium niobate lead titanate crystalline solutions are being studied for the purpose of achieving enhanced electrically induced strains and electromechanical coupling coefficients. Compositional modifications are being investigated that lead to improved performance coefficients with reduced hysteresis. Studies are being performed by dielectric spectroscopy, piezoelectric spectroscopy, and electrically induced strain and polarization methods. It is hoped that the investigations will lead to the development of the next generation of high-performance transducer/projector materials for underwater acoustical imaging applications in lateral waters.




Barium titanate is one of the most important ferroelectric materials. The interrelationships between the structure and properties in this material are being studied by changing the La and Sn contents. These investigations are being performed by dielectric spectroscopy and transmission electron microscopy, with particular attention being paid to the influence of impurities on the phase transformational characteristics and domain structure. The purpose of this study is to develop new lead-free relaxor-like ferroelectric materials for electrostrictive applications.




Minor amounts of CaO and SiO2 are being added to MnFe2O4 to study their effects on the electrical transport properties of the ferrite. The additives are concentrated in the grain boundaries, which is believed to produce high-resistance grain boundaries, surrounding more conductive grains, thus reducing eddy current losses at high frequencies in the ferrite. It is also found that the concentration of dopant in the grain boundary prevents decomposition of the ferrite in oxidizing atmospheres, thus maintaining the stoichiometry of the high- resistance ferrite. Impedance spectroscopy, thermogravimetry, and electrochemical cell measurements are being used in the study.



INTERFACES




State of Illinois; IBHE-HECA; U.S. Department of Energy,





The objective of this project is to use surface/interface sensitive x- ray diffraction/scattering techniques, e.g., grazing incidence diffraction/scattering/fluorescence, specular reflectivity, standing and evanescent wave experiments, and truncation-rod experiments (all of which require the use of the synchrotron radiation) to examine various materials systems of scientific and technological importance. Some specific areas of investigation are: studies of the reconstructed structure, stress fields, relaxations, roughness, and phase transitions of single-crystal surfaces and interfaces such as Ag/Si(111), Ge/Si, C60/Si, Cu/Al2O3, SnO2/Al2O3, GaN/Al2O3; the dynamical structural and compositional evolution associated with melting, solidification, passivation, and corrosion.




The individual atomic events contributing to the growth of crystals and films are being explored on the atomic level. Through the use of the field ion microscope, single atoms are visualized, and processes such as condensation, diffusion, nucleation, and incorporation into the lattice are examined quantitatively to reveal how structure and chemical composition affect growth processes.




The fatigue behavior of mullite fiber reinforced Al-Mg alloy matrix composites is examined as a function of Mg concentration and fiber volume fraction. The primary objective is to understand the role of the interface in the fatigue crack initiation and growth processes. Several reaction products are found at the fiber/matrix interface in the as-received composite. Research is in progress to evaluate the effect of the interfacial reaction on the fatigue properties of the composite.




Experimental and theoretical studies are carried out to understand the relationship between microstructure and mechanical properties of bi- materials interfaces. We have developed new experimental techniques to measure mechanical properties of interfaces and applied these techniques to metal-ceramic, metal-polymer, glass-ceramic, and bi- metals interfaces. We are developing model interfacial microstructures at graphite-epoxy, alumina-aluminum, polyimide-copper, epoxy-metal, and solder-copper interfaces by chemical, physical, electrochemical, and metallurgical surface-modification techniques. We are modeling several salient mechanisms of crack growth, such as crack sliding, crack interlocking, and crack tip plasticity, along model interfaces.



MATERIALS CHEMISTRY





The sol-gel processing route was used to synthesize thin layers of various compositions in the Pb(ZrxTi1-x)O3 system. Low-temperature crystallization behavior is believed to be influenced by local order and the coordination of the species in the starting precursor structure. The aim of this research was to understand how structure evolves through drying, thermolysis, densification, and crystallization. The observed transformation from molecular level heterogeneity at lower temperatures to intermediate range order, and eventually to the long-range ordered perovskite structure at higher temperatures, was determined by EXAFS spectroscopy.




To minimize the size of electronic components, a great deal of research has been carried out to develop new materials with higher dielectric constants. In addition to the demand for smaller electronic components, the need for Pb-free dielectric materials is also a major concern. Because of its high electric-field strength and good compatibility with microelectronic processing, Ta2O5 is widely used as an alternative to SiO2 for dielectric layers in thin-film capacitors. In addition, the dielectric constant can be increased by addition of Ti and Zr.



MECHANICAL BEHAVIOR OF SOLIDS





This program is applying our knowledge of the mechanisms of hydrogen embrittlement of metals to develop an understanding of the factors which strengthen alloys against environmental attack. The systems studied include high-strength aluminum alloys, beta titanium alloys, and the high-alloy nickel-based alloys. The experimental techniques used include mechanical property tests, electron microscopy, in situ environmental cell TEM, secondary ion mass spectrometry, and Auger spectroscopy. In most of the above alloys the studies include the effects of solutes and hydrogen on grain boundary fracture.




The effects of hydrogen on the structure and properties of intermetallics (nickel and iron aluminides) are being studied using the environmental cell TEM and other analytical techniques. To understand the role of the environment on the lack of ductility in polycrystalline Ni3Al, the effect of boron on the distribution of deuterium around grain boundaries is being mapped by using SIMS.




The interactions of gaseous hydrogen environments on the properties of metal systems is being studied directly by using an environmental cell TEM. Use of this microscope permits gas-solid interactions to be studied in real time and at high spatial resolution. The focus of the program is primarily on the effects of aggressive environments on the mechanical behavior. Specifically, we are investigating the effect of hydrogen on the stress field of dislocations and on the stacking-fault energy by monitoring the change in dislocation node spacing in the presence and absence of gas.




Ti-based alloys are being considered for a wide range of aerospace applications, and in some uses they will be exposed to elevated temperatures and harsh chemical environments. This program is aimed at developing an understanding of the effects of hydrogen on the mechanical properties of b-Ti alloys. Studies of the effect of hydrogen on the bulk mechanical properties are coupled to results from deformation experiments performed in a gaseous environment in situ in a TEM. This combination of experimental techniques allows the bulk property changes to be understood from a microscopic point of view.




The ability of ceramic materials to withstand high-temperature and hostile environments offers great prospects for potential major improvements in the design performance of high-temperature components in chemical processing, power generation, and industrial waste recovery applications. Their use as structural materials, however, has been limited primarily because of their poor fracture toughness and lack of damage tolerance. The purpose of this program is to examine the fundamental micromechanisms of high-temperature subcritical crack growth in three classes of ceramic-matrix composites chosen to reflect different primary room temperature toughening mechanisms, namely, crack deflection, crack trapping, and crack bridging.




The fracture mechanisms of particulate-reinforced metal-matrix composites are examined in several aluminum- and titanium-matrix composites at room and elevated temperatures. Most composite systems show a low-temperature fracture behavior controlled primarily by the reinforcing particles, with the matrix playing an inactive role in resisting the crack growth. The fracture properties of these composites are characterized by low fracture toughness, relatively flat R-curves, and weak dependence on the composition and microstructure of the matrix alloy. It is shown that a more efficient use of the matrix plasticity, which makes the fracture process more matrix-dominated, can lead to significant improvement in the fracture properties of these composites.




This research project studies the effect of high stresses on the intrinsic properties of solids. A particular emphasis is on the collective formation of crystal defects in the presence of high stresses and the implications of these special defect formation mechanisms for the brittle failure of materials and the transition to ductility. The experiments involve testing dislocation-free crystals in tension and probing the defect content dynamically with electrical resistivity and x-ray diffraction. The collective nucleation of dislocations is modeled with analytical methods and computer simulations. The materials studied include TiAl and NiAl intermetallics, Si, and metal whiskers.




g/a2 two-phase alloys based on intermetallic compound TiAl are high- strength, low-density materials for applications at high temperatures, e.g., as turbine and compressor blades in aircraft engines. This research investigates (1) the relationship between microstructure and the mechanical properties such as yield strength, creep resistance, and toughness and (2) the control of microstructures by means of heat treatment and mechanical working. The experiments involve microscopy characterization of microstructure over the nanometer to micrometer range and mechanical property tests. The relationship between the microstructure and mechanical properties is modeled, based on the dislocation pile-up mechanism and the continuum theory of dislocations.



MICROELECTRONICS PACKAGING MATERIALS AND PROCESSES





The origin of dimensional anisotropy and tape movement is studied using rheological techniques and in situ stress measurements. Rheological properties of tape casting suspensions are characterized to probe their relaxation behavior. Stress measurements based on a laser interferometry technique are carried out on tape-cast layers of varying thickness and composition. Our goal is to develop a fundamental understanding of property evolution during drying of these complex colloidal systems.




The techniques of in situ TEM deformation and hot-stage microscopy are being used to study the interaction of dislocations with grain boundaries, the operation of grain boundary dislocation sources, and the interaction of mobile grain boundaries with obstacles such as precipitates. These studies are being undertaken to provide an understanding of the physical processes controlling grain boundary cavitation, grain boundary sliding, grain boundary dislocation interactions, and grain nucleation at precipitates.



PHASE TRANSFORMATION AND MICROCHARACTERIZATION





Severe plastic deformation can force immiscible elements into solid solution, as observed during ball milling of Cu-Co or Cu-Ag powder blends. We are developing a program that uses analytical techniques with atomic resolution to elucidate the mechanisms controlling such transformations. This is combined with modeling and computer simulation to develop tools for rationalizing existing behavior and for anticipating possible new microstructures or properties.



U.S. Department of Energy, DE-FG02-96ER45439; Nippon





This is a comprehensive interdisciplinary program of basic research on displacive transformations in ceramics. The ultimate aim is to raise the level of understanding of these transformations to that comparable with martensitic transformations in metallic systems. The program involves studies concerning precursor phenomena and phonon effects, elasticity properties, transformation crystallography, static displacements, chemical and structure ordering, and kinetics. Systems currently being studied are KNbO3, PbTiO3, and BaT:O3, as well as relaxor ferroelectrics PMN, PST, and PLZT.



Illinois Board of Higher Education HECA; U.S. Department





The Materials Research Laboratory is engaged in a collaborative effort with personnel from the Oak Ridge National Laboratory, National Institute of Standards and Technology, and UOP Research Inc. for the development of two beam lines of the Advanced Photon Source (APS) being constructed at the Argonne National Laboratory. The foci of this effort are to do research and to educate new generations of scientists and engineers at the cutting edge of the science and engineering in various disciplines. Particular efforts presently underway and planned are in surface/interface diffraction, magnetic scattering, inelastic scattering, Mössbauer effect, diffuse scattering, and macromolecular crystallography. H. Chen is the director of this APS beam-line development project.




The principal means by which Ni-based superalloys strengthen themselves is precipitation hardening. Recent years have seen a renewed interest in the phenomena of Ostwald ripening. The classical theory has recently been modified to incorporate the effect of finite volume fraction and the coherency stresses due to lattice mismatch. These factors can have profound effect on the precipitates' growth kinetics and their final size distribution. There is an acute need for experimental verification, which is the principal goal of this research. We have found for the first time enhanced coarsening rate due to lattice misfit strain via small-angle neutron scattering measurements. Further study is being conducted using TEM to confirm the scattering results.



Illinois Board of Higher Education HECA; U.S. Department





Anomalous x-ray scattering studies of a lead-magnesium-biobate (PMN) single crystal were carried out to study its superstructure. Ordering was observed by the presence of 1/2(111) type superlattice peaks. By tuning the energy of the synchrotron radiation to values close to the Pb LIII absorption edge, the superstructure was shown to include Pb, either by atomic exchange or large displacements. Recent synchrotron x-ray data show the Bragg peak intensities changed not only with temperature but also with aging time. Further work is needed to separate these two effects and to understand the ordering-temperature relationship.



UOP Research Center Grant; U.S. Department of Energy,





Zeolites find wide applications in petrochemical industries owing to their unique properties, such as absorbents, catalysts, and ion exchangers. Many studies have concentrated on the synthesis of new zeolite types and possible applications for zeolites. The underlying molecular events which govern crystallization are still poorly understood. With the brilliant synchrotron radiation source at APS available as well as state-of-the-art position-sensitive detectors, it becomes possible to carry out the in situ studies using SAXS and WAXS techniques to monitor the whole process of zeolite crystallization, with the precursor gel transformation monitored by SAXS and crystallization by WAXS simultaneously.




The degree to which ordering exists in high-temperature alloys can be probed by diffuse scattering experiments in which pair-correlations for compositional and/or magnetic order are measured. We will develop and apply a first-principles theory of alloys which directly determines these correlations, based on the underlying electronic and magnetic interactions. For the first time, the results of the scattering experiments can be related directly to the electronic structure of metallic alloys, thereby elucidating the microscopic reasons for the structural ordering. Identifying the underlying mechanisms responsible for the observed short-range order provides valuable guidance in the design of new and improved alloys and represents a significant advance in alloy theory.




Large-scale molecular dynamic simulations of inorganic compounds are carried out to study the mechanisms of phase transformations. Phase transitions are induced by simulated pressure or temperature changes. The unstable modes of motion on a local scale are identified by Fourier filtering particle trajectories and by performing normal mode analysis on static structure. Because of the size of the systems, it is possible to study the propagation of transformation fronts and the formation of domains. This research targets issues which arise in conjunction with wear-resistant hard coatings, high-temperature structural ceramics, amorphization under pressure, and relaxor ferroelectrics.



POLYMERS





Fundamental studies aimed at understanding the mechanism of adsorption and desorption of contaminants in activated carbons is being pursued. This includes determining factors that control pore diameter, pore diameter distribution, and surface character (acidity vs. basicity). With this kind of basic knowledge it is anticipated that one can design greatly improved adsorption systems to control a wide range of atmospheric pollutants, including CO2, freons, SOx, and indoor air contaminants. Carbon particles measuring 130Å to 1000Å will be chemically functionalized and then reacted to form cross- linked structures. These macrostructural polymers will be examined in terms of their structural features, thermomechanical properties, and potential use as advanced filtration systems.




C.




A broadly based program to develop improved matrices for advanced ceramic composites based on boron nitride is being pursued. The borazine oligomer used to form the boron nitride is also being examined as a precursor to BN in the form of a thin-film dielectric insulator as well as adhesion for high-temperature ceramics.




Single-crystal flakes of aluminum diboride in an epoxy matrix have been shown to yield outstanding planar mechanical properties far in excess of those achievable with graphite fiber epoxy composites. The current program is directed at exploring AlB2 aluminum matrix composites to develop an understanding of the crystallization kinetics of the flakes, ability to process directly into shapes, and establishing the strength-limiting characteristics of such composites.




It has been shown for two families of flexible segment containing thermotropic main chain liquid crystal polymers, that chain-folded lamellae develop during crystallization from the liquid crystal state in quiescent and sheared thin films, annealed solution grown (folded chain) single crystals, and on the surfaces of bulk samples. Extended chain lamellae, when formed, are suggested as developing from a chain- folded morphology by sliding diffusion. Simultaneous polymerization crystallizations, on the other hand, lead to the growth of lamellar extended chain crystals. Electron diffraction has permitted characterization of the crystal structure and transition behavior.




The morphology, crystal structure, and changes therein with temperature of a wide variety of homopolymer and both random and alternating copolymer lamellar (100Å thickness) single crystals and single disclination domains have been characterized by electron microscopy and diffraction. Polymers include many rigid polyester LCPs, PET, PBT, PEN, Kevlar, Kapton, polyethers, and polyanhydrides. The high-temperature lattices for poly(p-oxybenzoate) and their relationship to the low-temperature lattices have been clarified. Crystal structures of many of the polymers have been determined by the use of electron diffraction aided by modeling. The polymers are prepared by a unique, low-temperature, confined, thin-film melt polymerization process.




Macrocrystals (up to 0.1 mm) of several liquid crystal homo- and copolymers have been prepared by a variation of the confined thin-film polymerization technique. They are composed of lamellae ca. 100Å thick, presumably extended chain in nature, and all with a common alignment. Their chemical structure (alternating vs. random) and transition behavior are being characterized by infrared microscopy/thermal analysis for comparison with electron diffraction studies. Growth rates are being observed by hot-stage optical microscopy as a function of film thickness, temperature, and composition.




C) yields morphologies varying from single-crystal whiskers (up to 50 m length) to hexagonal platelet crystals (2-5 m thickness and up to 100 m lateral size). Effects of time, temperature, concentration, and stirring have been characterized. The platelets are suggested to form by a mechanism similar to that described by Bassett (University of Reading) for extended chain platelets of linear polyethylene, i.e., transformation from a hexagonal columnar liquid-crystal state to an orthorhombic lattice. Electron diffraction is used to characterize the relative arrangement for the crystalline domains after the transformation.




Electron diffraction patterns from the confined thin-film melt polymerized lamellar crystals and solution-grown whisker single crystals have been used for ab initio direct phasing crystal structure studies. Current emphasis is on poly(p-oxybenzoate) (phase I and II) and poly(terephthalate anhydride). Excellent agreement has been obtained for poly(p-oxybenzoate) in comparison to molecular Cerius2 program.




C, 70 degrees below the monomer melting point. The polymer formed consists of lamellae, ca. 100 Å thick, composed of extended chains. Rapid chain extension occurs on heating to the polymer's nominal Tk-m. Incorporation of glass fibers or polymer whiskers results in overgrowths with excellent adhesion; the molecules are normal to the plane, parallel to the whiskers. Applications as nanocomposites, normal composites, coatings, and adhesives are being explored.




A high polymer can adsorb tightly from solution to a surface even if its individual monomers do not, by virtue of a large aggregate free energy of sticking. The focus of experimental work has been to measure equilibrium effects. The dynamic aspects of polymer adsorption are not understood. In this work, polymer populations at a surface are measured by infrared spectroscopy. By measuring the kinetics of adsorption, desorption, and surface diffusion at well-characterized surfaces, our goal is to understand the dynamics of mass transfer in thin interfacial regions.




The objective of this research is to probe the tribology of polymer and surfactant boundary layers on a molecular level. We have developed new methods for measuring frictional forces between surfaces that are close to one another (a few angstroms), but not actually touching. With these methods, we measure the viscosity and static shear strength of liquids of thickness comparable to molecular dimensions.




The project revolves around the tribology of perfluoroether fluids under extreme but nonetheless well-defined conditions of shear rate and confinement. This will allow one to understand the surface chemical and rheological components of perfluoroether friction, as distinct from the classical ones that are rooted in the solid-solid contact. Interpretation from molecular viewpoints is emphasized.




This collaborative research between Exxon and the University of Illinois involves work in both laboratories. The conceptual objectives are to establish specific science connections beween microscopic observables and tribological properties of fluids at interfaces in chemically reactive environments. Specifically, we will integrate spectroscopic probes and rheological measurements in model asperity contacts.




Underway are systematic studies of surface-surface interactions based on the rational design of known protein and polymer interfaces. We are interested in the effects of peptide composition, electrostatic and hydrophobic properties, and especially conformations and specific interactions with polymers.




The adsorption of polymers with infrared-active vibrations in the skeletal backbone is studied by infrared spectroscopy in attenuated total reflection to give direct information about chain flattening through dichroic measurements. Of particular interest is the dependence of surface rearrangement rates on the surface coverage. History dependence is expected to be related to the high local density.




This work brings together two laboratories in university-industry cooperation to (1) employ a newly designed tribometer to examine energy dissipation at intermediate length scales, between molecularly thin films and the continuum limit and (2) integrated spectroscopic and newly designed tribological measurements to "see" what actually occurs at the interface while sliding takes place.




Systematic studies are underway of particle-particle nanorheology based on the concurrent measurement of static and dynamic forces in both the shear and normal directions. This is relevant to an enormous range of fine powder applications based on rheological properties in an environment that is not dry (among them fluidization and rapid shear flow in riser reactors, segregation processes, and mixing and pneumatic conveying).




Microscopic statistical mechanical theories of diblock copolymer melts and solutions are being developed and applied to understand single- chain conformation, collective concentration fluctuations, small-angle neutron scattering measurements, and the molecular factors that control phase separation. The influence of chain branching, backbone stiffness, and intermolecular attractive forces on the order-disorder microphase separation transition of polyolefins have been determined. Excellent agreement with recent x-ray and neutron scattering experiments has been demonstrated. Micelle and aggregate self-assembly in dilute selective solvents is also under investigation.




Microscopic theories of the dynamics of nonlinear macromolecular solutions and melts are being developed based on modern statistical dynamical methods. The mechanical response, diffusion, and conformational relaxation times of macromolecules modeled by fractal mass distributions are studied. Detailed applications to experimental systems such as polymer rods, macromolecular rings, and spherical microgel fluids are in progress. Generalization of the theory for linear chains to treat self and tracer diffusion and shear viscosity in solutions, melts, and gels is being pursued.




Microscopic theories for the conformation and structure of self- assembling multiblock copolymers and ionomers are being developed. The influence of block length and composition on long wavelength concentration fluctuations, microdomain formation, and phase separation temperature have been systematically explored. Application to address small-angle scattering and the microphase behavior of multiblock polyurethane melts and ionomer melts have been carried out. The role of water, nonpolar solvents, and blending with homopolymers on ionomer structure physical clustering and bulk properties are of interest.




Microscopic, off-lattice integral equation theories of dense polymer mixtures are being developed and applied. The influence of density fluctuations, molecular architecture, and interchain forces on collective fluctuations, thermodynamic properties, interchain packing, and phase diagrams is being established via analytic and numerical approaches. Detailed applications to blends of hydrocarbon chains are being carried out and compared with small-angle neutron scattering measurements. Generalizations of the theory to treat specific interactions, lower critical solution type phase separation, and the blend equation-of-state are being pursued.




A microscopic statistical dynamical theory of self and tracer diffusion in polymer blends and diblock copolymer solutions and melts has been developed. Long wavelength concentration fluctuations and microdomain formation are predicted to result in slowing down of diffusion and in enhanced entanglement coupling in a manner which depends on alloy composition, distance from the phase boundary, tracer and matrix polymer molecular weight, and overall polymer density. Generalizations to treat chain dynamics, rheology, and dielectric response are also under study.




Microscopic liquid state theories of mixtures of polymers and colloids are being developed. The role of macromolecular structure, colloid size, composition, and intermolecular interactions on equilibrium properties are being systematically explored. A prime goal is to develop a microscopic understanding of the influence of controllable suspension variables on structure, clustering, and colloid flocculation.




Microscopic statistical mechanical theories of the structure, thermodynamics, and phase diagrams of mixtures of polymers and spherical particles are being developed. The particles may be nanometer-sized proteins or micelles, larger objects such as dendrimers, or micron-sized colloids. The complex influences of particle size, polymer concentration and molecular weight, and steric and specific attractive forces on mixture equilibrium properties are under study.




This project investigates molecular conformation and phase structure in blends consisting of flexible polymers dissolved as guests in a liquid crystal polymer host. The experimental work involves measurements by broad-line proton NMR, polarized light microscopy, and differential scanning calorimetry. We have discovered that a number of polymers can acquire orientation parallel to the director axis of the liquid crystal polymer host. A very significant observation has been the guest's induction of liquid crystalline order in highly mobile (possibly isotropic) molecular segments of the host. This may be an example of liquid crystallinity induced by a binary interaction.




This project investigates the synthesis and properties of novel polymers containing paramagnetic organometallic structural units in their backbone structure. One of the systems synthesized is a copolymer of diamagnetic chemical sequences and paramagnetic units containing tetradentate copper II complexes. This system was found to form a liquid crystalline phase above its melting point and therefore acquires molecular orientation in the presence of an external magnetic field. At the present time we are studying both its orientation kinetics and solid-state structure. We are using the system's paramagnetic nature not only to study magnetic properties of organic polymers but also to probe cooperative phenomena.




This project investigates several systems that order spontaneously into specific microscopic patterns or molecular structures in the specific topologies. One system under investigation is the binary alloy of two chemically periodic nematic polymers. We are interested in this system's phase diagram and its microscopic patterns of phase separation. Other systems of interest are self-assembling monomers for the formation of molecular sheets, ladders, and combs.




This project investigates the synthesis of comb homopolymers and copolymers containing chiral centers in side chains. It is of interest here to study the ability of such polymers to form selective membranes for chiral separation. So far copolymers have been synthesized that exhibit smectic mesophases with phase transitions that can be controlled by achiral co-monomers.




Over the past few years our laboratory initiated research with the specific objective of focusing on the use of functionalized liquid crystal polymers as the molecular components on the interface. We succeeded in synthesizing a prototype system containing functions reactive toward surfaces and matrices. Interestingly, these self- ordering comb polymers were found to order spontaneously on the surfaces of carbon fibers over thousands of molecular layers. Very recently we have been able to place a "single molecular layer" of these polymers on a carbon surface and have observed the remarkable result that this monomolecular layer generates to macroscopic evidence of improved load transfer across a carbon fiber- epoxy interface.



Center for Composite Materials Research, ONR N00014-86-





This research focuses on the synthesis of new molecules and new molecular architectures of interest in the nonlinear optical phenomenon known as second harmonic generation (SHG). A system has been investigated that contains 2-D polymers synthesized in our laboratory. The 2-D architecture of polymer molecules in these films leads to excellent temporal stability of the noncentrosymmetric structure as required for SHG photonic materials. We have also discovered recently that a derivative of the precursor to these 2-D polymers self-assembles into noncentrosymmetric "macroscopic" films with remarkable second order susceptibility.




A synthetic pathway is described to construct "in bulk" 2-D polymers shaped as molecular sheets. A chiral oligometic precursor containing two reactive sites, a polymerizable group at one terminus and a reactive stereogenic center placed near the center of the molecule, is used. The 2-D molecular objects form through molecular recognition by the oligomers, which self organize into layers that place the reactive groups within specific planes. The oligomers become catenated by two different stitching reactions involving the reactive sites. This observation suggests that the transformation of common polymers from a 1-D to a 2-D architecture may produce generations of organic materials with improved properties.




We have synthesized a polymer consisting of a monodisperse, rod-like segment coupled to a monodisperse coil-like segment and have observed it to form microphase separated structures. The rod-like segment, an aperiodic sequence containing aromatic units, and the coil-like segment, polyisoprene, share the same molecular backbone. When not attached covalently to the coil, the aromatic rod-like segment forms a compound that melts into a liquid crystalline phase demonstrating the stiff segment's high aspect ratio. A film of the "rodcoil" polymer when cast from a selective solvent exhibits microphase separation, forming ribbons or strips as well as small aggregates that have dimensions in the range of the rod-like molecular segments.



PROCESSING





This research is being conducted to examine the relationship between microstructure and mechanical performance in the Al2O3-ZrO2 eutectic system. The study will concentrate on densification processes, thermal instability associated with phase distribution of zirconia in this eutectic composite. The effect of processing on the microstructural- mechanical properties will be evaluated.




Stabilized zirconia is a fast oxygen conductor and as such is widely used in solid oxide fuel cell applications. Microstructural defects like grain boundaries raise the ac impedance in this material. We are investigating the effects on electrical properties of placing a second oxygen-conducting phase at the grain boundaries, which we attempt to achieve by coating zirconia powders with that phase prior to consolidation. The goal of the work is to tailor the temperature- dependent oxygen conductivity by adjusting the type and thickness of this secondary phase.




We are experimentally examining the energetics and kinetics of microstructure evolution in heterophase systems by patterning simple, controlled-geometry microfeatures of ceramic phases onto crystalline substrates. By exploring the influences of the initial geometry and heteroepitaxy on equilibrium morphology and on coarsening and coalescence rates, we should be able to derive quantitative data on relative interfacial energies and on the rate-controlling mass transport mechanism governing the evolution. Such information is crucial to understanding the processing of materials ranging from thin ceramic layers to structural composites.




During sol-gel processing, structural developments occur as a result of network condensation. Consequently, the rigidity of the structure and the resistance it offers to the escaping solvent increase. Pressure gradients build and the gels risk fracture. Using Brillouin light scattering in the course of the drying process, we monitor the complex mechanical modulus, characterizing the dynamic response of these gels on a molecular scale. This yields information concerning the change of elastic properties and viscous dissipation, as controlled by chemical composition and drying rates.




We are carrying out rheological measurements (stress viscometry and oscillatory measurements) to probe the effects of free (nonadsorbed) polymeric species in concentrated, nonaqueous suspensions. Free polymer species influence particle-particle interactions, and, hence, suspension "microstructure" through depletion phenomena. However, relatively little is known about such phenomena even though free polymeric species are often present in significant amounts in these systems. Our observations have highlighted the importance of depletion stabilization in such systems. Ultimately, we aim to develop a theoretical model for this effect.




Gel casting is a near-net shape-forming process suitable for complex 3-D components. We are studying the gelation behavior of aqueous suspensions that contain high solids volume fraction in the presence of low molecular weight polymeric additives (e.g., polyvinyl alcohols). Such systems are environmentally benign and produce consolidated bodies with low organic content facilitating subsequent debinding processes.




Solid free-form fabrication enables the production of prototypes and parts directly from CAD files, without the need for hard tooling, and is presently explored for the production of ceramic components. Our objectives are to develop the polymer/ceramic mixtures suitable for controlled fused deposition of specific ceramic materials and to investigate the debinding, sintering, and microstructure development processes in components produced by this technique.



RADIATION DAMAGE IN MATERIALS





The goals of this study are (1) to develop the basic understanding of the behavior of interfaces in materials submitted to radiation field and (2) to investigate the consequences for the microstructure- properties relationship in these materials. Two types of behavior are currently being investigated by atomistic computer simulations and irradiation experiments: the coarsening of ordered domains and the shape of precipitates in two-phase materials. In these two cases, the evolution of the alloy is mostly controlled by dynamical processes taking place at interfaces, such as atomic mixing and interface roughening. We have determined that irradiation can induce a nonequilibrium roughening as well as a nonequilibrium faceting of precipitates at steady-state.




The focus of this program is to provide an understanding of the basic processes of damage formation by heavy-ion irradiation of metal systems. Transmission electron microscopy is used extensively to characterize the damage structure as a function of ion dose and irradiation temperature. The experimental information obtained is used to evaluate current damage models and to provide a better understanding of how material properties are affected in a nuclear reactor and how irradiation with energetic heavy-ions modifies the surface properties of a material.




Fundamental aspects of ion-beam-induced amorphization and layer intermixing in III-V semiconductor heterostructures are being studied by using a combination of low-temperature ion channeling and transmission electron microscopy techniques. Specifically, we are interested in understanding the effect of increasing the Al content on the ion dose needed to cause amorphization in the AlGaAs system and the mechanisms of mixing in AlGaAs-GaAs heterostructures.




Ion implantation is used extensively in the semiconductor industry to introduce dopants. The accompanying damage must be removed before devices can be activated. The focus of this effort is on understanding the mechanisms of solid-phase epitaxial crystallization of amorphous material in simple and compound semiconductors. The regrowth process can be stimulated by means of an energetic electron beam, which allows, through variation of the electron energy, the role of defects created in the crystalline material (interstitials and vacancies) or interface defects (dangling bonds or charged kinks) to be directly assessed.




High-purity group Va and VIa metals exhibit the so-called anomalous slip behavior at low temperatures (e.g., <200 K in Nb and 77 K in Ta). To understand this transition in deformation behavior, samples of high-purity tantalum will be deformed in situ in the transmission electron microscope as a function of temperature. Such studies will also yield direct information on the relative mobilities of edge and screw dislocations and their interactions with each other and with other obstacles as a function of temperature.



STRUCTURAL CERAMICS





Basic aspects of ion beam modifications of materials are being investigated. These studies include ion beam mixing, defect production, radiation-enhanced diffusion, and ion beam-assisted film growth. The work combines molecular dynamics computer simulation with experimental studies using MBE grown films and 1 keV to 3 MeV ion beams and various surface analysis methods. Metals, intermetallic compounds, oxide ceramics, and compound semiconductors are of interest.




Basic aspects of diffusion and radiation-induced defects in model ceramic oxide materials are investigated. Specimens especially grown by MBE methods, tailored to specific experiments, ion beam analysis, and x-ray diffraction and SIMS comprise the methods of study.




Nanophase processing is a novel technique by which metallic and ceramic materials can be produced in the form of ultrafine powders with sizes in the range of 5 to 50 nm. The resulting powder particles, called nanophase or nanocrystalline powder, can be cold compacted at or near room temperature to near theoretical density. The novel microstructure of ceramics thus produced can impart several useful engineering properties. Ongoing research on these nanophase ceramics includes sintering kinetics, fracture strength and toughness, and superplastic deformation. The goal of the research program is to identify useful engineering properties of the nanophase ceramics and to understand their structure and property relationships.




The structure of nanoparticles and their interactions with one another and with substrates are examined on an atomic scale using high- resolution transmission electron microscopy and molecular dynamics computer simulations. Sintering of small assemblies of nanoparticles, epitaxial relationships between the particles and substrates, and the dependence of size on alloy phase stability are investigated.




This research involves preparation of chemically stabilized b- crystobalite powders synthesized by the solution polymerization technique employing Pechini resin and PVA solution as a polymeric carrier and consideration of mullite-cordierite composites with b- cristobalite interfaces showing the optimum phase transformation weakening behavior at the laminate/matrix interface. We are investigating grain size effects on the bÆa transformation of cristobalite and fabricating laminate structure by the tape-casting process including the control of thermal and co-firing conditions between them.



U.S. Air Force Office of Scientific Research Science





Amorphous fibers synthesized by laser-heated, containerless methods are being tested to develop a process to convert them into single- crystal fibers. These fibers are projected to have important applications for reinforcing ceramic matrix composite materials. The kinetic parameters of the crystallization process have been determined using differential thermal analysis (DTA). The measured kinetic parameters were then used to determine rates of crystallization as a function of temperature and time. Additionally, the crystallinity of the fibers and their microstructure have been evaluated using various spectroscopic techniques including TEM, optical microscopy, and SEM. Strength values of the fibers have been measured using tensile testing techniques.




C.




Modern ceramic fabrication techniques are being applied to inexpensive raw materials to produce strong lightweight building panels. Emphasis is on common clays, fly ash, bottom ash, and diatomaceous earth as raw materials. Lignin sulphonate, a by-product of the paper industry, is used as a foam-stabilizing agent in fabricating foamed ceramic construction materials. Sol incorporation and gellation, with careful control of pH and rheology, is similarly being evaluated in fabrication, as is phosphate bonding. Combustible additives, such as sawdust, and expansive additives, such as vermiculite, are also being studied as means of decreasing density. Extruded honeycomb structures will be produced and evaluated.




Detailed microstructural and microchemical investigation of polymer- derived fibers and matrices is being performed. In particular, the amorphous/crystalline nature of the materials and the presence of second phases are being studied. The effect of various processing conditions and exposure to various environments on fibers and fiber/matrix interfaces is being investigated using a variety of microanalytical techniques.




We are investigating mechanisms of high-temperature oxidation of hot- pressed SiC-AlN compositions. The dense materials are either composites or solid solutions, depending on processing conditions. The oxidation is strongly affected by the formation and further reaction of several layers found at the outer surface, such as SiAlON and mullite, and by microstructural factors. High-resolution and analytical TEM, as well as SEM and XRD, are used in the investigation.



SUPERCONDUCTORS





The current-carrying capability of bulk polycrystalline superconductors is limited because of their "weak link" behavior. This behavior results from misorientation of individual grain boundaries, unfavorable grain boundary chemistry, porosity, or the presence of microcracks. We have developed a novel technique to produce grain-aligned YBa2Cu3O7-x that couples magnetic alignment with partial melt processing. Magnetically aligned films are densified near the peritectic temperature to promote partial melting. The oriented, unmelted Y123 grains then act as seeds for textured growth during recrystallization. We are currently investigating the role of second phase additions on the peritectic decomposition reaction, microstructural development, and properties of YBa2Cu3O7-x thick films.




A new high-pressure facility provides a unique capability for high-Tc research. Work is directed at synthesis and growth of layered structure compounds and on new exploratory studies of superconducting structures. Attention is paid to the hole-doped materials of possible d-wave nature, which are believed to give the highest Tc's. In addition to high pressure synthesis, electrochemical crystal gowth also gives rise to the high oxidation capability, which is important for the formation of hole-doped high-Tc superconductors. Experiments are designed to improve the quality of crystals and to explore new layered-structure compounds for high-Tc superconductivity.



SURFACE STUDIES, COATINGS, AND LASER PROCESSING





This project involves characterization of corrosion growths in water pipes. Sample sections of pipes are removed from working drinking water systems in various cities. Water treatments are run through the systems for a period of time ranging from six months to two years, and then another sample section is removed from the system. These sections are shipped to the University of Illinois, where qualitative characterization of before-treatment and after-treatment pipes is done to determine the effectiveness of the water treatments used. Characterization techniques used include light microscopy, SEM, EDS, and XRD.




While not altogether new, anodic spark deposition (ASD) is a most promising and versatile process for the application of a wide range of novel ceramic coatings that has yet to be exploited. It is a comparatively rapid, subconventional temperature process that occurs at the positive electrode of an electrolytic cell via a complex set of reactions that involves sparking. The aim of this research is to determine the feasibility of the application of diamond and/or diamondlike carbon films by ASD. Such films have also been put down in connection with this program by chemical vapor deposition techniques.




Gas tight layers of stabilized zirconia are being deposited on carbon from vapors of the chlorides by means of the local electrochemical cell set up by the electrolytic properties of the growing ceramic coating. The electrolytical properties of the coating are being evaluated as a means of protecting the carbon from oxidation at elevated temperatures in an oxidizing atmosphere. Polarization processes at the carbon electrode are being evaluated by potentiometric measurements, and the volume of oxidation reaction products is being monitored by means of a Bunsen tower.



Motorola Inc.; University of Illinois Manufacturing THIN-FILM ELECTRONICS





C suitable for fabrication on plastic substrates.




Our goal is to develop a low-temperature growth process for thin-film hydrogenated amorphous silicon (a-Si:H) and silicon nitride (a-SiNx:H) layers, which are used as the semiconductor and dielectric materials in thin-film transistors, respectively. The films are grown using reactive magnetron sputter deposition, fabricated into field-effect devices, and analyzed. We recently demonstrated a record high mobility using a buried channel configuration.




We are investigating a new method for the deposition of titanium nitride thin films: remote plasma processing from metal-organic CVD precursors. The remote plasma approach has the potential to bring together the best features of the chemical and physical vapor deposition routes for the synthesis of ultrahard coatings: the high growth rates, low temperatures, and conformal coverages characteristic of CVD and the dense, polycrystalline microstructure of the PVD process. A major component of this research is an investigation of the chemistry using in situ reflection-absorption infrared spectroscopy and modulated mass spectroscopy with isotopic labelling experiments.




We study the nucleation and growth of polycrystalline silicon (px-Si) thin films on glass substrates at relatively low substrate temperatures ( C) using real-time, in situ spectroscopies. The goals are to determine the kinetics of hydrogen and silicon hydride adsorption, diffusion, reaction and elimination from the growing surface, and the effects of fast particle bombardment on these processes; to develop realistic models of px-Si film deposition; and to improve px-Si growth methods based on this knowledge. We seek a reaction pathway which yields high-quality px-Si in the as-deposited state, as opposed to the deposition of an amorphous silicon (a-Si) or fine-grained px-Si film followed by thermal recrystallization.




This work is intended to elucidate the electronic stability of thin- film silicon devices that have been passivated by deuterium instead of by hydrogen. The impetus for this work comes from the recent discovery that the use of deuterium sharply decreases the rate at which MOS transistors degrade by electron-impact reactivation of interface states at the SiO2/Si interface and the rate at which amorphous silicon photovoltaic devices degrade under illumination. The goal of our project is to establish the existence, magnitude, and kinetics of the deuterium passivation effect in a third class of silicon-based materials, namely, polycrystalline silicon thin-film transistors.




We are interested in studying solid-state reactions involving thin films of metals deposited on semiconductor substrates (Si or GaAs). The samples are characterized using standard thin-film analysis tools such as TEM and x-ray diffraction. In order to study the kinetics of the reaction, the sheet resistance of the film is monitored in situ during the annealing process using a four-point probe assembly. By monitoring the changes in the sheet resistance versus time we can attempt to understand the rate-determining mechanisms of the reaction. We plan to use this technique in both traditional furnaces and rapid thermal annealing (RTA) systems.




We plan to explore several areas related to small metal structures in a typical integrated circuit. The first area is the measurement of metal-to-metal contact resistance of small-area interconnect metallization systems. The second area of interest explores the reactions induced by local heating using a small resistance heater (microheater) fabricated with photolithography techniques. These heaters act as "fuses" in some IC systems. We are also exploring the possibility of building a scanning tunnelling potentiometer to electrically characterize these small structures.




C) SPE growth of Si-Ge films on Si(100). This is accomplished by thermally annealing a-Ge/Au bilayers deposited on Si(100) using thermal evaporation. RBS, TEM, ion channeling, and AES were used to characterize the microstructure of the films. The process of the growth is studied using XTEM and in situ resistivity measurements.




Ti metallization plays an important role in state-of-the-art MOS processing technology. Not only is it used extensively for SALICIDE formation for source/drain contacts, but it is also used to form conductive TiN diffusion barriers needed for reliable contacts with aluminum metallization. We investigate the reaction sequence in this system using both in situ measurements such as differential resistivity measurements and ex situ microstructure analysis, including TEM and XRD.




We are developing a new technique that is potentially a very powerful method for directly obtaining quantitative values for small enthalpy of reactions at interfaces, surfaces, and near surface regions. This microcalorimeter is expected to have high sensitivity, capable of measuring extremely small amounts of heat generated during solid/solid reactions and surface processes as well as low enthalpy of internal microcrystalline processes. This technique will be useful for measuring the kinetics of interface reactions, such as the nucleation of silicides at buried interfaces, and the study of near-surface processes, such as point-defect annihilation and coalescence of vacancies in Si following ion implantation.




C in the melting point of Sn nanostructures, which agrees with the liquid-shell model describing the size-dependent melting point depression.




A wide variety of techniques for the deposition of thin films utilize bombardment of the growth surface by low-energy ions to enhance film properties. We are studying the deposition of metal films using a low- energy metal ion beam with a well-defined energy that can be varied between 5 eV and 200 eV. In situ scanning tunneling microscopy is used to characterize the surface morphology. When we combine this technique with ex situ x-ray diffraction and transmission electron microscopy studies, we form a nearly complete picture of the dependence of film microstructure on the energy of depositing atoms.




Ceramic coatings are widely used as thermal barriers to increase the maximum operating temperature of metal alloys. Our research project seeks a greater understanding of the role of atomic-sized defects, internal interfaces, and porosity on the thermal conductivity of oxide coatings. Experimental coatings are deposited using magnetron sputtering. Our newly developed measurement technique enables us to measure the thermal conductivity of films only 100 nm thick over a wide temperature range, 80-800 K.



U.S. Army Construction Engineering Research Laboratories,





Thermal plasma processing shows great promise as a technology for the remediation of toxic wastes. Unfortunately, the extremely high temperatures produced in plasma-arc melting can lead to significant loss of metals from the molten slag by evaporation. The Plasma Arc Facility at the University of Illinois is extensively instrumented to allow real-time monitoring and control of plasma-arc processing of model systems for contaminated wastes. We are studying the kinetics of metal evaporation and particle generation using optical probes.




Our experiments on the fundamentals of crystal growth by molecular beam epitaxy (MBE) and etching by low-energy ions take place in the EpiCenter, a collaborative facility for research in physics, electrical engineering, and materials science. We use in situ scanning tunneling microscopy (STM) to quantify the surface structure and morphology of a wide variety of semiconductors and metals. The STM studies include atomic resolution imaging as well as systematic studies of morphology evolution during low-temperature processing.




We use molecular dynamics calculations and scanning tunneling microscopy to study collective behavior during energetic ion impacts with solid surfaces. Collective behavior such as thermal spikes can produce qualitative differences in the morphology and microstructure produced by ion implantation in comparison to the predictions of binary collision models. The experiments take advantage of the EpiCenter facility to produce clean surfaces of a wide variety of materials and quantify the morphologies produced by ion impacts.




For improved hardness, corrosion resistance, and decorative purposes, titanium nitride has received a wide range of applications. Fundamental problems involving adhesion, interface strength, effect of residual stress on strength, texture effect on properties, etc., are some of the significant topics that still require systematic investigation. Moreover, refining coating procedures to improve the aforementioned properties by introducing new microstructure remains a great challenge. This program involves the deposition and characterization of TiN thin films obtained by ion beam assisted deposition (IBAD) and laser ablation depostion (LAD) methods. A variety of microstructure/microchemistry techniques along with mechanical and corrosion testing are carried out.




We use ex situ and in situ electron microscopy to study thin films. Thin films are grown by molecular beam epilaxy, or gas reaction, in specially built ultrahigh-vacuum transmission electron microscopes. Quantitative measurements from images are used to extract stress magnitudes or examine ordering in films.




We use in situ transmission electron microscopy to understand the growth of Ga and Al nitrides on sapphire substrates. The growth method is reactive molecular beam epitaxy.




Multitarget sputtering techniques have been developed to allow the sequential deposition of ultrathin (10-100 Å) alternating layers of metastable (GaAs)1-x (Si2)x and GaAs. Preferential sputtering has been investigated and excellent control over film chemistry has been demonstrated. The structural perfection and electronic properties of such intercalated structures are being studied. Superlattice x-ray scattering techniques are also being used to study thermal and ion bombardment enhanced diffusion in these materials.




The growth of high-quality, mixed, III-V ternary and higher order single-crystal thin films by MBE incorporating reactive species using low-energy accelerated ion beams is being investigated. Structural perfection, optoelectronic properties, and composition of deposited alloy films are related to growth conditions. An understanding of this relationship may allow the development of new classes of multicomponent materials by exploiting the fact that sputtering is basically a physical rather than a chemical growth technique.




The primary objective of this research is to develop a detailed understanding of energetic particle/surface interactions for controllably altering nucleation and growth kinetics, microchemistry, and physical properties of metal and semiconductor films during deposition from the vapor phase by a variety of techniques including ion-assisted MBE, plasma-assisted CVD, sputter deposition, and primary-ion deposition. Low-energy ion/surface interactions allow the crystal grower additional dynamic control, at the atomic level, over microchemistry and microstructural evolution. Kinetic energy can be efficiently coupled to the growth surface thereby altering surface reactivity as well as adsorption, adatom diffusion, and nucleation kinetics.




We are developing a general model for the prediction and analysis of elemental incorporation probabilities and depth distributions of dopants in vapor phase deposited films as a function of experimental parameters such as film material, dopant, film growth temperature, growth rate, and the flux and kinetic energy of dopant species incident at the growing film surface. The model accounts for dopant diffusion, surface segregation, and low-energy ion bombardment effects. Model predictions are tested using accelerated-beam MBE as well as glow discharge and ultrahigh vacuum ion beam sputter deposition in which actual doping profiles will be determined by secondary ion mass spectrometry (SIMS) and, where applicable, capacitance/voltage and Hall effect measurements.




Chemical reaction paths can be affected by laser-induced photochemistry. We are investigating semiconductor crystal growth using focused laser beams to initiate heterogeneous reactions at substrate surfaces as well as by gas-phase photodissociation. LCVD offers a unique opportunity to probe the thermodynamics and kinetics of controlling gas phase and gas-surface reactions during film growth due to the spatial, temporal, and wavelength selectivity of coherent light sources.




Transition-metal nitrides such as TiN are used extensively as hard and wear-protective coatings for mechanical components, as abrasion- resistant optical coatings, and as diffusion barriers in integrated circuits. We have grown the first single-crystal TiN layers, using ultrahigh vacuum reactive magnetron sputter deposition on MgO, and have investigated their mechanical, electrical, and optical properties. We have also grown the first epitaxial nitride strained- layer superlattices, TiN/VN, and have found that they have mechanical and electrical properties that are a strong function of the superlattice period. Recently, we have grown metastable NaCl-structure (Ti, Al)N alloys and have found that they have greatly enhanced high- temperature oxidation resistance.




This program addresses three fundamental issues in CuInSe2 (CIS) solar cell technology: (1) grain boundaries and their effects on second- phase populations, bulk grain conductivity, and heterojunction behavior; (2) stoichiometry and point defects; and (3) control of electronic properties and carrier collection of the heterojunction through the CIS chemistry. Experiments involve (1) growth of single- crystal and polycrystalline layers as a function of thickness, composition, substrate, and growth parameters; (2) testing of the structural, chemical, electronic, and optical properties of the fabricated materials; and (3) modification of the chemistry of the layers.




CuInSe2 semiconductor coatings are being deposited by combining sputtered fluxes of Cu and In with an evaporated flux of Se. This approach takes advantage of the strengths of both the sputtering and evaporation processes while removing the requirement for using H2Se as a working gas. The project also involves studies of CuInSe2 deposition where a portion of the evaporated Se flux is ionized and accelerated in the direction of the substrate. Emphasis is on the basic mechanisms of coating growth and the resultant electronic properties of the coatings. The coatings are examined both by direct measurement and by fabricating and testing CuInSe2/CdS heterojunction devices.



JOURNALS AND BOOKS


Bioceramics
LEE, S. J., W. M. KRIVEN, and H. M. KIM. Shrinkage free, alumina-glass, dental composites by aluminum oxidation. J. Amer. Ceram. Soc., 80, 2141-2147 (1997).

Cementitious Materials
OLSON, R. A., P. D. TENNIS, D. BONEN, H. M. JENNINGS, T. O. MASON, B. J. CHRISTENSEN, A. R. BROUGH, G. K. SUN, and J. F. YOUNG. Early containment of high-alkaline solution simulating low-level radioactive waste in blended cement. J. Hazardous Waste, 52, 223-236 (1997).

Ceramic and Glassy Solids
LIPOWITZ, J., J. A. RABE, A. ZANGVIL, and Y. XU. Properties of SYLRAMIC silicon carbide fiber--a polycrystalline, stoichiometric b-SiC composition. Ceram. Engr. Sci. Proc., 18:3, 147-57 (1997).
YOUNGMAN, R. E., J. KIEFFER, J. D. BASS, and L. DUFFRÈNE. Extended structural integrity in network glasses and melts. J. Non-Cryst. Solids, 222, 190-198 (1997).

Computer Simulations of Materials
GAYLORD, R. J. Cellular automata explorations: chemotaxis. Mathematica Educ. Res., 6:3, 41-45 (1997).
GAYLORD, R. J. Cellular automata explorations: driven diffusion of two species. Mathematica Educ. Res., 6:2, 37-42 (1997).
GAYLORD, R. J. Cellular automata simulations in materials science: solidification. Mathematica Educ. Res., 6:1, 34-36 (1997).
GAYLORD, R. J. Cellular automata simulations in materials science: spinodal decomposition. Mathematica Educ. Res., 5 4, 22-26 (1997).
GAYLORD, R. J. A cellular automata programming toolkit. Mathematica Educ. Res., 5:3, 61-67 (1997).
GAYLORD, R. J. and K. NISHIDATE. Modeling Nature: cellular Automata Simulations Using Mathematica. (TELOS/Springer-Verlag, 1997) (Japanese Ed.).
JOHNSON, D. D. and M. ASTA. Energetics of homogeneously-random fcc Al-Ag alloys: a detailed comparison of computational methods. Comput. Mater. Sci., 8, 54 (1997).
REARDON, B. J. and J. KIEFFER. Atomistic mobility in supercooled liquids via normal mode analysis and molecular dynamic simulations. Ceram. Trans., 69, 195-202 (1997).

Electrical Ceramics
CHO, C. R., D. A. PAYNE, and S. L. CHO. Solution deposition and heteroepitaxial crystallization of LaNiO3 electrodes for integrated ferroelectric devices. Appl. Phys. Lett., 71, 3013-3015 (1997).
KALINECHEV, A. G., J. D. BASS, B. N. SUN, and D. A. PAYNE. Elastic properties of tetragonal PbTiO3 single crystals by Brillouin scattering. J. Mater. Res., 12, 2623-2627 (1997).
LEE, S. W., P. P. TSAI, and H. CHEN. H2 sensing behavior of MOCVD derived SnO2. Thin Films Sensors Actuators, B41, 55-61 (1997).
SCHWARTZ, R. W., J. A. VOIGHT, B. A. TUTTLE, T. L. REICHERT, R. S. DASALLA, and D. A. PAYNE. Comments on the effects of solution precursor characterization on crystallization behavior of sol-gel derived PZT thin films. J. Mater. Res., 12, 444-456 (1997).
SENGUPTA, S. S., S. M. PARK, and D. A. PAYNE. Integrated electroceramics: densification and stress development in sol-gel derived thin layers. Integ. Ferroelectr., 14, 193-200 (1997).

Interfaces
CHEN, X. and J. M. GIBSON. Dramatic effect of postoxidation annealing on (100) Si/SiO2 roughness. Appl. Phys. Lett., 70, 1462 (1997).
GIBSON, J. M., X. CHEN, and O. POHLAND. Transmission electron microscopy of surface and interfacial steps. Surf. Rev. Lett., 4, 559 (1997).
PEDDADA, R. S., I. M. ROBERTSON, and H. K. BIRNBAUM. Growth of Ti thin films on sapphire substrates. J. Mater. Res., 12:7, 1856-1865 (1997).

Materials Chemistry
CLEM, P. G., N. L. JEON, R. G. NUZZO, and D. A. PAYNE. Monolayer mediated deposition of Ta2O5 thin film microstructures from solution precursors. J. Amer. Ceram. Soc., 80, 2821-2827 (1997).
JEON, N. L., P. G. CLEM, D. Y. JUNG, W. LIN, G. S. GIROLOMI, D. A. PAYNE, and R. G. NUZZO. Additive fabrication of integrated ferroelectric thin-film capacitors using self-assembled organic thin-film templates. Adv. Mater., 9, 891-895 (1997).
SINGHAL, A., J. M. GIBSON, and J. C. YANG. Stem-based mass spectroscopy of supported Re clusters. Ultramicroscopy, 67, 191 (1997).

Mechanical Behavior of Solids
LUNT, M. J. and Y. Q. SUN. Slip creep of Ni3Ga. Scr. Met., 36, 599 (1997).
SUN, Y. Q. An explanation of the small strain-rate sensitivity of Ni3Al. Acta Met., 45, 3527 (1997).
VETRANO, J. S., S. M. BRUEMMER, L. M. PAWLOWSKI, and I. M. ROBERTSON. Influence of the particle size on recrystallization and grain growth in Al-Mg-X alloys. Mater. Sci. Engr., A238, 101-107 (1997).

Phase Transformation and Characterization
ALTHOFF, J. D. and D. D. JOHNSON. Concentration-wave analysis of atomic pair correlations in disordered ternary alloys: application to Cu2NiZn. Comput. Mater. Sci., 8, 71 (1997).
ASTA, M. and D. D. JOHNSON. Thermodynamics of fcc-based Al-Ag alloys: implications for the formation of Guinier-Preston zones. Comput. Mater. Sci., 8, 64 (1997).
ATHENES, M., P. Bellon, and G. Martin. Identification of novel diffusion cycles in B2 ordered phases by Monte-Carlo simulations. Phil. Mag. A, 76, 565-585 (1997).
GIBSON, J. M. and M. M. J. TREACY. Diminished medium range order in annealed amorphous semiconductors. Phys. Rev. Lett., 78, 1074 (1997).
KITA, E., S. KONDO, H. IWO, M. FURUSAKA, K. SIRATORI, H. Y. LEE, and H. CHEN. Neutron and x-ray small angle scattering studies of rapidly quenched La-Fe alloys. J. Phys. Soc. Japan, 66:2, 451-454 (1997).
McCORMACK, R., M. ASTA, J. J. HOYT, B. C. CHAKOUMAKOS, S. T. MISTURE, J. D. ALTHOFF, and D. D. JOHNSON. Experimental and theoretical investigations of order-disorder in Cu2AlMn. Comput. Mater. Sci., 8, (1997).
MURALIDHARAN, G., M. C. PETRI, J. E. EPPERSON, and H. CHEN. Interaction of Si and Al during interdiffusion in Ni-Al-Si alloys. Scr. Mater., 36:2, 219-225 (1997).
MURALIDHARAN, G., J. W. RICHARDSON, JR., J. E. EPPERSON, and H. CHEN. Lattice parameters and compositions of g and g¢ during coarsening in the Ni-Al-Si system: a neutron powder diffraction study. Scr. Mater., 36:5, 543-549 (1997).
POCHET, P., L. CHAFFRON, P. BELLON, and G. MARTIN. Phase transformations under ball-milling. Ann. Chim. Sci. Mater., 22, 363-372 (1997).
POPOOLA, O. O. and W. M. KRIVEN. Phase transformation in KNbO3 perovskite ceramic. Phil. Mag. Lett., 75, 1-5 (1997).
STAUNTON, J. B., M. F. LING, and D. D. JOHNSON. A theoretical treatment of atomic short-range order and magnetism in iron-rich bcc alloys. J. Phys.: Cond. Matter, 9, 1281 (1997).

Polymers
DALEY, M. D., C. L. MANGUN, J. A. DEBARR, S. SIHA, A. A. LIZZIO, G. L. DONNALS, and J. ECONOMY. Adsorption of SO2 onto oxidized and heat treated activated carbon fibers. Carbon, 35:3, 411 (1997).
DAVID, E. F. and K. S. SCHWEIZER. Liquid state theory of thermally driven segregation in conformationally asymmetric diblock copolymer melts. Macromolecules, 30, 5118 (1997).
DEAN, D. and P. H. GEIL. Unique morphology of poly(azomethine ethers) sheared in the liquid crystalline state. Acta Polym., 48, 149 (1997).
DEPPISCH, C. L., J. K. LIU, J. K. SHANG, and J. ECONOMY. Processing and mechanical properties of AlB2 flake reinforced Al alloy composites. Mater. Sci. Engr. A, 225, 153 (1997).
DHINOJWALA, A. and S. GRANICK. Micron-gap rheo-optics with parallel plates. J. Chem. Phys., 107, 8664 (1997).
DHINOJWALA, A. and S. GRANICK. Relaxation time of confined aqueous films under shear. J. Amer. Chem. Soc., 119, 241 (1997).
DHINOJWALA, A. and S. GRANICK. Surface forces in the tapping mode: permeability and hydrodynamic thickness of adsorbed polymer brushes. Macromolecules, 30, 1079 (1997).
DOUGLAS, J. F., H. M. SCHNEIDER, P. FRANTZ, R. LIPMAN, and S. GRANICK. Origins and characterization of conformational heterogeneity in adsorbed polymers. J. Phys. Cond. Matter, 9, 7699 (1997).
ECONOMY, J., D. FRICH, and L. A. SCHNEGGENBURGER. LCP polyesters vs thermosetting polyesters: a paradigm for research in the 21st century. Macromol. Symp., 118, 11-22 (1997).
FRICH, D and J. ECONOMY. Thermally stable liquid crystalline thermosets based on aromatic copolyesters: preparation and properties. J. Polym. Sci. A, Chem. Ed., 35:6, 1061 (1997).
FRICH, D. and J. ECONOMY. Optimizing adhesion properties of thermosetting aromatic copolyesters. Polym. Engr. Sci., 37:3 (1997).
FRICH, D., C. GORANOV, L. A. SCHNEGGENBURGER, and J. ECONOMY. Novel high temperature aromatic copolyester thermosets: synthesis, characterization and physical properties. Macromolecules, 29, 7734 (1997).
FUCHS, M. and K. S. SCHWEIZER. Mode-coupling theory of slow dynamics of polymeric liquids: fractal macromolecular architectures. J. Chem. Phys., 106, 347 (1997).
FUCHS, M. and K. S. SCHWEIZER. Polymer mode-coupling theory of finite-size-fluctuation effects in entangled solutions, melts and gels. I. General formulation and predictions. Macromolecules, 30, 5133 (1997).
FUCHS, M. and K. S. SCHWEIZER. Polymer mode-coupling theory of finite-size-fluctuation effects in entangled solutions, melts and gels. II. Comparison with experiments. Macromolecules 30, 5156 (1997).
GUENZA, M. and K. S. SCHWEIZER. Fluctuation effects in diblock copolymer fluids: comparison of theories and experiment. J. Chem. Phys., 106, 7391 (1997).
GUENZA, M. and K. S. SCHWEIZER. Local and microdomain scale fluctuation effects in block copolymer solutions. Macromolecules, 30, 4205 (1997).
GUENZA, M., H. TANG, and K. S. SCHWEIZER. Suppression of entangled diblock copolymer diffusion at and below the order-disorder transition. Macromol.-Commun., 30, 3423 (1997).
HUGGINS, K. E., S. SON, and S. I. STUPP. Two-dimensional supramolecular assemblies of polydiacetylenes. I. Synthesis, structure and third order nonlinear optical properties. Macromolecules, 30:18, 5305 (1997).
LI, L. S. and S. I. STUPP. Two-dimensional supramolecular assemblies of polydiacetylenes. II. Morphology, structure and chromic transitions. Macromolecules, 30:18, 5313 (1997).
LIU, J. and P. H. GEIL. Crystal structure and morphology of poly(ethylene terephthalate) single crystals prepared by melt polymerization. J. Macromol. Sci. (Phys.), B36, 61 (1997).
LIU, J. and P. H. GEIL. Electron diffraction and computer modeling studies of the crystal structure of poly(butylene terephthalate) a-form single crystals. J. Macromol. Sci. (Phys.), B36, 263 (1997).
LIU, J. and P. H. GEIL. Electron diffraction and computer modeling of poly(naphthalic anhydride) crystal structure. J. Polym. Sci., Polym. Phys., B35, 1575 (1997).
LIU, J., B. L. YUAN, P. H. GEIL, and D. L. DORSET. Chain conformation and molecular packing in poly(p-oxybenzoate) single crystals at ambient temperature. Polymer, 38, 6031 (1997).
LUCERO, A., F. RYBNIKAR, T. C. LONG, J. LIU, P. H. GEIL, B. WALL, and L. KOENIG. Lamellar macrocrystals of nascent liquid crystal polymers. Polymer, 38, 4387 (1997).
LUENGO, G., J. N. ISRAELACHVILI, A. DHINOJWALA, and S. GRANICK. Generalized effects in confined fluids: new friction map for boundary lubrication. Wear, 205, 246 (1997).
RADZILOWSKI, L. H., B. O. CARRAGHER, and S. I. STUPP. Three-dimensional self assembly of rodcoil copolymer nanostructures. Macromolecules, 30:7, 2110 (1997).
RYBNIKAR, F. and P. H. GEIL. Morphology, crystal structure and orientation of poly(p-oxybenzoate) on mica. J. Polym. Sci., Polym. Phys., B35, 1807 (1997).
SCHNEGGENBURGER, L. A., P. OSENAR, and J. ECONOMY. Direct evidence of sequence ordering of random semi-crystalline copolyesters during high temperature annealing. Macromolecules, 30, 3754-3758 (1997).
SCHWEIZER, K. S. and J. G. CURRO. Integral equation theories of the structure, thermodynamics and phase transitions of polymer fluids. Advances in Chemical Physics, 98, chapt. 1 (1997).
SCHWEIZER, K. S., M. FUCHS, G. SZAMEL, M. GUENZA, and H. TANG. Mode-coupling theory of the slow dynamics of entangled macromolecular fluids. Macromolec. Theory Simulat., 6, 1037 (1997).
SHI, F. and J. ECONOMY. Aliphatic/aromatic copolyester thermoset adhesives: synthesis and characterization. Polym. Engr. Sci., 37, 549 (1997).
SING, C. and K. S. SCHWEIZER. Coupled enthalpic-packing effects on the miscibility of conformationally asymmetric polymer blends. Macromolecules, 30, 1490 (1997).
SOGA, I., A. DHINOJWALA, Y.-K. CHO, and S. GRANICK. Direct measurement of the molecular orientation of confined molecules under shear. Dynamics in Small Confining Systems (Drake, Troian, Kopelman, Klafter, eds.) Mater. Res. Soc., 89 (1997).
STUPP, S. I., V. LE BONHEUR, K. WALKER, L. S. LI, K. HUGGINS, M. KESER, and A. AMSTUTZ. Supramolecular materials: self organized nanostructures. Science, 276, 384 (1997).
STUPP, S. I. The challenge of assembling molecules into materials. Macromol. Symp., 117, 1 (1997).
STUPP, S. I. and P. V. BRAUN. Molecular manipulation of microstructures: biomaterials, ceramics, and semiconductors. Science, 277, 1242 (1997).
SUKHISHVILI, A. and S. GRANICK. Formation and characterization of covalently bound polyelectrolyte brushes. Langmuir, 13, 4935 (1997)
TOHVER, V., P. V. BRAUN, M. U. PRALLE, and S. I. STUPP. Counterion effects in liquid crystal templating of nanostructured CdS. Chem. Mater., 9, 1495 (1997).

Processing
LEE, S.-J., W. M. KRIVEN, J.-H. PARK, and Y.-S. YOON. Bonding behavior of a Cu/CuO thick film on a low-firing ceramic substrate. J. Mater. Res., 12, 2411-2418 (1997).
YANG, J. C., M. YEADON, D. OLYNICK, and J. M. GIBSON. Anomalous desorption of copper oxide observed by in-situ transmission electron microscopy. Micros. Microanal., 3, 121 (1997).
YEADON, M., J. C. YANG, M. GHALY, D. OLYNICK, ET AL. In-situ observations of classical grain growth mechanisms during sintering of copper nanoparticles on (001) copper. Appl. Phys. Lett., 71, 1631 (1997).

Radiation Damage in Metals
SIMEONE, D., O. Hablot, V. Micalet, P. Bellon, and Y. Serruys. Contribution of recoil atoms to irradiation damage in absorber materials. J. Nucl. Mater., 246, 206-214 (1997).

Structural Ceramics
HUANG, C. M., D. ZHU, C. X. DONG, W. M. KRIVEN, R. LOH, and J. HUANG. Carbon-coated glass fiber reinforced cement composites: I. Fiber push-out and interfacial properties. J. Am. Ceram. Soc., 80:9, 2326-2332 (1997).
HUANG, C. M., C. Y. YUH, M., FAROOQUE, D. ZHU, Y. XU, and W. M. KRIVEN. Properties and microstructure of MoSi2 - ߢ SiAlON particulate ceramic composites. Amer. Ceram. Soc., 80:11, 2837-2843 (1997).
KELLY, W. H., A. N. PALAZOTTO, R. RUH, J. K. HEUER, and A. ZANGVIL. Thermal shock resistance of mullite and mullite-ZrO2-SiC-whisker composites. Ceram. Engr. Sci. Proc., 18:3, 195-203 (1997).
KIM, S. and W. M. KRIVEN. Preparation, microstructure and mechanical properties of silicon carbide-dysprosia composites. J. Amer. Ceram. Soc., 80:12, 2997-3008 (1997).
KRIVEN, W. M., D. ZHU, M. H. JILAVI, K. R. WEBER, B. CHO, J. FELTEN, and P. C. NORDINE. Synthesis and microstructure of mullite fibers grown from deeply undercooled melts. Ceramic Microstructures '96 (Tomsia and Glaeser, eds.; Plenum Pub.) 173-180 (1997).
KUO, D. H. and W. M. KRIVEN. A strong and damage-tolerant oxide laminate. J. Amer. Ceram. Soc., 80, 2421-2424 (1997).
KUO, D. H. and W. M. KRIVEN. Microstructure and mechanical evaluation of yttrium phosphate-containing and lanthanum phosphate-containing zirconia laminates. Ceram. Engr. Proc., 18, 129-136 (1997).
KUO, D. H., W. M. KRIVEN, and T. J. MACKIN. Control of interfacial properties through fiber coatings: monazite coatings in oxide/oxide composites. J. Amer. Ceram. Soc., 80:12, 2987-2996 (1997).
MULLNER, P. and W. M. KRIVEN. On the rod deformation twinning in domain reorganization and reorientation in ferroelastic crystals. J. Mater. Res., 7, 1771-1776 (1997).
XU, Y., A. ZANGVIL, and A. KERBER. SiC nanoparticle-reinforced Al2O3 matrix composites: role of intra- and intergranular particles. J. Euro. Ceram. Soc., 17:7, 921-28 (1997).
ZHU, D., H. CHUNG, M. JILAVI, W. M. KRIVEN, and J. MAZUMDER. Microstructure and interfacial properties of a laser ablation coated, fiber-reinforced ceramic composite. Ceram. Engr. Proc., 18, 105-112 (1997).
ZHU, D., M. H. JILAVI, and W. M. KRIVEN. Synthesis and characterization of mullite and YAG fibers grown from deeply undercooled melts. Ceram. Engr. Process., 18, 31-38 (1997).

Superconductivity
LEWIS, J. A., A. C. READ, and T. K. HOLMSTROM. Transport properties of magnetic field/liquid assisted texturing of YBa2Cu3O7-x tape-cast films. IEEE Trans. Appl. Supercond., 7:2, 1440-1442 (1997).

Thin-Film Electronics
ALLEN, L. H. and S. L. LAI. MEMS based scanning calorimetry for thermodynamic properties of nanostructures. Microscale Thermophys. Engr., 2, 40 (1997).
BERGSTROM, D. B., I. PETROV, L. H. ALLEN, and J. E. GREENE. Aluminide formation in polycrystalline Al/W metal/barrier thin-film bilayers: reaction paths and kinetics. J. Appl. Phys., 82, 201 (1997).
CHEY, S. J. and D. G. CAHILL. Surface defects created by low energy (20-240 eV) ion bombardment of Ge(001). Surf. Sci., 380, 377 (1997).
HAMDANI, F., A. BOTCHKAREV, W. KIM, H. MORKOC, ET AL. Optical properties of AgN grown on ZnO by reactive MBE. Appl. Phys. Lett., 70, 467 (1997).
KARR, B. W., I. PETROV, D. G. CAHILL, and J. E. GREENE. Morphology of epitaxial TiN(001) grown by magnetron sputtering. Appl. Phys. Lett., 70, 1703 (1997).
KIM, H., G. GLASS, T. SPILA, N. TAYLOR, S. Y. PARK, J. R. ABELSON, and J. E. GREENE. Si(001):B gas-source molecular-beam epitaxy: boron surface segregation and its effect on film growth kinetics. J. Appl. Phys., 82:5, 2288-2297 (1997).
KIM, H., N. TAYLOR, T. SPILA, G. GLASS, S. Y. PARK, J. E. GREENE, and J. R. ABELSON. Structure of the Si(011) 16x2 surface and hydrogen desorption kinetics investigated using temperature programmed desorption. Surf. Sci., 380:2-3, L496 (1997).
KIM, W., M. YEADON, A. E. BOTCHKAREV, S. N. MOHAMMED, ET AL. Surface roughness of nitrided (0001) Al2O3 and AlN epilayers grown on (0001) Al2O3 by reactive MBE. J. Vac. Sci. Technol., B15, 921 (1997).
KUO, H., J. KUO, Y. WANG, C. LIN, H. CHEN, and G. E. STILLMAN. Determination of the band offset of GaInP-GaAs and AlInP-GaAs quantum wells by optical spectroscopy. J. Electron. Mater., 26:8, 944-948 (1997).
LAI, S. L. and L. H. ALLEN. Thin-film nanocalorimetry for nano-scaled systems. Electrochem. Soc. Proc., 97-11, 59 (1997).
LAI, S. L., G. RAMANATH, P. INFANTE, and L. H. ALLEN. Heat capacity measurements of Sn nanostructures using a thin-film differential scanning calorimeter with 0.2 nJ sensitivity. Appl. Phys. Lett., 70, 43 (1997).
LEE, S.-M. and D. G. CAHILL. Heat transport in thin dielectric films. J. Appl. Phys., 81, 2590 (1997).
LEE, S.-M. and D. G. CAHILL. Thermal conductivity of Si-Ge superlattices. Appl. Phys. Lett., 70, 2957 (1997).
LU, Q., M. R. SARDELA, N. TAYLOR, G. GLASS, T. BRAMBLETT, T. SPILA, J. R. ABELSON, and J. E. GREENE. B incorporation and hole transport in fully-strained heteroepitaxial Si1-xGex grown on Si(001) by gas-source MBE from Si2H6, Ge2H6, and B2H6. J. Cryst. Growth, 179:1-2, 97 (1997).
C by dc reactive magnetron sputtering. Appl. Phys. Lett., 70:2, 226 (1997).
McCORMICK, C. S., C. E. WEBER, J. R. ABELSON, G. A. DAVIS, R. E. WEISS, and V. AEBI. Low-temperature fabrication of amorphous silicon thin film transistors by dc reactive magnetron sputtering. J. Vac. Sci. Technol., A15:5, 2770 (1997).
NELSON, A. J., G. BERRY, A. ROCKETT, D. K. SHUH, J. A. CARLISLE, D. G. SUTHERLAND, and L. J. TERMINELLO. Observation of core-level binding energy shifts between (100) surface and bulk atoms of epitaxial CuInSe2. J. Appl. Phys., 70:14, 1873-1875 (1997).
NURUDDIN, A. and J. R. ABELSON. Does a dipole layer at the p-i interface reduce the built-in voltage of amorphous silicon p-i-n solar cells? Appl. Phys. Lett., 71:19 (1997).
PARK, D.-G., Z. CHEN, D. M. DIATEZUA, Z. WANG, A. ROCKETT, H. MORKOC, and S. A. ALTEROVITZ. Thermal stability of Si3N4/Si/GaAs interfaces. Appl. Phys. Lett., 70:10, 1263-1265 (1997).
SCHROEDER, D. and A. A. ROCKETT. Electronic effects of sodium in epitaxial CuIn1-xGaxSe2. J. Appl. Phys., 82:10, 4982-4985 (1997).
SENGUPTA, D. K., W. FANG, J. I. MALIN, A. CURTIS, T. HORTON, H. C. KUO, D. TURNBULL, C. H. LIN, K. C. HSIEH, S. L. CHUANG, I. ADESIDA, M. FENG, S. G. BISHOP, G. E. STILLMAN, J. M. GIBSON, H. CHEN, J. MAZUMDER, and H. C. LIU. Effects of rapid thermal annealing on the device characteristics of quantum well infrared photodetectors. J. Electron. Mater., 26:1, 43-51 (1997).
SENGUPTA, D. K., T. HORTON, W. FANG, A. CURTIS, J. LI, S. L. CHUANG, H. CHEN, M. FENG, G. E. STILLMAN, A. KAR, J. MAZUMDER, L. LI, and H. C. LIU. Redshifting of a bound-to-continuum GaAs/AlGaAs quantum-well infrared photodetector response via laser annealing. Appl. Phys. Lett., 70:26, 3573-3575 (1997).
SENGUPTA, D. K., W. FANG, J. I. MALIN, J. LI, T. HORTON, A. P. CURTIS, K. C. HSIEH, S. L. CHUANG, H. CHEN, M. FENG, G. E. STILLMAN, L. LI, H. C. LIU, K. M. S. V. BANDARA, S. D. GUNAPALA, D. GUNAPALA, and W. I. WANG. GaAs/AlGaAs quantum-well infrared photodetector on GaAs-on-Si substrates. Appl. Phys. Lett. 71:1, 78-80 (1997).
SENGUPTA, D. K., S. L. JACKSON, W. FANG, J. I. MALIN, T. U. HORTON, A. P. CURTIS, H. C. KUO, A. MOY, J. MILLER, K. C. HSIEH, K. Y. CHENG, H. CHEN, I. ADESIDA, S. L. CHUANG, M. FENG, and G. R. STILLMAN. Growth and characterization of InP/InGaAs p-quantum well infrared photodetector with extremely thin quantum wells. J. Electron. Mater., 26:12, 1382-1388(1997).
SENGUPTA, D. K., S. L. JACKSON, W. FANG, J. I. MALIN, T. U. HORTON, Q. HARTMAN, A. P. CURTIS, H. C. KUO, S. THOMAS, J. MILLER, K. C. HSIEH, I. ADESIDA, S. L. CHUANG, M. FENG, G. E. STILLMAN, Y. C. CHANG, H. CHEN, J. M. GIBSON, J. MAZUMDER, L. LI, and H. C. LIU. Growth and characterization of n-type InP/InGaAs quantum well infrared photodetectors for response at 8.93 mm. J. Electron. Mater., 26:12, 1376-1381 (1997).
THEIL, J. A., E. KUSANO, and A. ROCKETT. Vanadium reactive magnetron sputtering in mixed Ar/O2 discharges. Thin Solid Films, 298:1, 122-129 (1997).
VON KEUDELL, A. and J. R. ABELSON. Evidence for atomic hydrogen insertion into strained Si-Si bonds in the a-Si:H sub-surface from in-situ IR spectroscopy. Appl. Phys. Lett., 71:26 (1997).
WANG, Z., G. RAMANATH, L. H. ALLEN, A. ROCKETT, J. P. DOYLE, and B. G. SVENSSON. Kinetics of thin film reactions of Cu/a-Ge bilayers. J. Appl. Phys., 82:7, 3281-3286 (1997).
YEADON, M., F. HAMDANI, G. Y. XU, A. SALVADOR, ET AL. Surface morphology and optical characterization of GaN grown on a-Al2O3 (0001) by radio frequency assisted molecular beam epitaxy. Appl. Phys. Lett., 70, 3023 (1997).



Papers presented at conferences and symposia


Cementitious Materials
AI, H. and J. F. YOUNG. Mechanism of shrinkage reduction using a chemical admixture. Proc. 10th Int. Congr. on the Chem. of Cements. Paper no. 3iii018. Inform Trycket AB. (Gothenburg, Sweden, Jun. 1997)
BAKHAREV, T., A. R. BROUGH, R. J. KIRKPATRICK, L. J. STRUBLE, and J. F. YOUNG. Chemical evolution of cementitious materials with high proportion of fly ash and slag in mechanisms of chemical degradation of cement-based systems. Mater. Res. Soc. Symp. Proc., Mechanisms of Chem. Degradation of Cement-based Syst. (Scrivener and Young, eds.) (Chapman and Hall, E & FN Spon) 307-314 (1997).
BAKHAREV, T., A. R. BROUGH, R. J. KIRKPATRICK, L. J. STRUBLE, J. F. YOUNG, R. OLSON, P. D. TENNIS, D. BONEN, H. JENNINGS, T. MASON, S. SAHU, and S. DIAMOND. Durability of cement stabilized low-level wastes in mechanisms of chemical degradation of cement-based systems. Mater. Res. Soc. Symp. Proc., Mechanisms of Chem. Degradation of Cement-based Syst. (Scrivener and Young, eds.) (Chapman and Hall, E & FN Spon) 350-357 (1997).
MATSUYAMA, H., J. A. LEWIS, and J. F. YOUNG. Dispersion mechanisms in processing of cement pastes. 2nd Ann. RILEM Conf. (Dijon, France, 1997).
SCRIVNER, K. L. and J. F. YOUNG (eds.). Mechanisms of Chemical Degradation of Cement-based Systems. Mater. Res. Soc. Symp. Proc. (Chapman and Hall, E & FN Spon, 1997).

Ceramics and Glassy Solids
GUILBERT, E., F. LI, J. D. BASS and J. KIEFFER. Complex mechanical response and pore structure of silica gels. Glass and Opt. Mater. Div., Amer. Ceram. Soc. Fall Mtg. (Williamsburg, Va., Oct. 1997).
KIEFFER, J. Structural assembly in glass-forming melts. Amer. Crystallog. Assn. Ann. Mtg. (St. Louis, Mo., Jul. 1997).
KIEFFER, J., R. E. YOUNGMAN, and J. D. BASS. Brillouin light scattering as a structural probe for inorganic glasses and melts. 30th Amer. Chem. Soc. Great Lakes Regional Mtg. (Chicago, Ill., May 1997).
REARDON, B. J., J. KIEFFER, J. E. MASNIK, and J. D. BASS. Relaxation processes in borate melts. Proc. 2nd Int. Conf. on Borate Glasses, Cryst., and Melts (Soc. of Glass Technol.) (Wright, Feller, and Hannon, eds.) 349-356 (1997).
YOUNGMAN, R. E., J. KIEFFER and J. D. BASS. Brillouin scattering studies of strong glass formers: B2O3 and GeO2 glasses and melts. 99th Ann. Mtg., Amer. Ceram. Soc. (Cincinnati, Ohio, May 1997).
YOUNGMAN, R. E., J. KIEFFER, and J. D. BASS. Brillouin light scattering studies of strong glass formers: boron oxide, germanium oxide, and silicon dioxide. 30th Amer. Chem. Soc. Great Lakes Regional Mtg. (Chicago, Ill., May 1997).
YOUNGMAN, R. E., J. KIEFFER, and J. D. BASS. Extended-range structural integrity in network glasses and melts. 14th Univ. Conf. on Glass Sci. (Bethlehem, Pa., Jun. 1997).
YOUNGMAN, R. E., J. KIEFFER, B. O'NEIL, and J. D. BASS. Pressure and temperature effects on the structure and glass transition behavior of boron oxide by Brillouin light scattering. Glass and Opt. Mater. Div., Amer. Ceram. Soc. Fall Mtg. (Williamsburg, Va., Oct. 1997).
YOUNGMAN, R. E., J. KIEFFER, and J. D. BASS. Structural developments upon glass formation. Glass and Opt. Mater. Div., Amer. Ceram. Soc. Fall Mtg. (Williamsburg, Va., Oct. 1997).

Computer Simulations of Materials
GAYLORD, R. J. Cellular automata modeling with Mathematica. Int. Conf. on Complex Syst. (Nashua, N. H., 1997).
JOHNSON, D. D. and W. A. SHELTON. Electronic origins for the short-range order and energetics in Ni-Fe INVAR alloys. Invited paper, The INVAR Effect--A Centennial Symp. (Wittenauer, ed.) (Minerals, Metals, and Materials Soc.) 63 (1997).
KIEFFER, J. Time-space-correlations of cation motion in alkali silicates. Mater. Res. Soc. Symp. Proc., 455, 331-336 (1997).
KIEFFER, J. and B. J. REARDON. Manifestations of chaos in atomic trajectories. 3rd Int. Discussion Mtg. on Relaxations in Complex Syst. (Vigo, Spain, Jun./Jul. 1997).
REARDON, B. J. and J. KIEFFER. Characterization of phase stability and transitions using normal mode analysis. 99th Ann. Mtg., Amer. Ceram. Soc. (Cincinnati, Ohio, May 1997).
REARDON, B. J. and J. KIEFFER. The role of chaos in molecular dynamics. Amer. Crystallog. Assn. Ann. Mtg. (St. Louis, Mo., Jul. 1997).

Electrical Ceramics
GOSULA, V. and H. CHEN. High-temperature study of PMN by x-ray diffraction. Int. Symp. on Dielectr. Ceram.: Process., Properties and Appl., ACS Mtg. (1997).
GOSULA, V., H. CHEN, S. TESLIC, and T. EGAMI. Ordered structure in lead magnoniobate (PMN) by resonant x-ray scattering. Mater. Res. Soc. Symp. Proc., Appl. of Synchrotron Radiation to Mater. Sci. III (San Francisco, Calif., 1997).
LEE, S. W., P. P. TSAI, and H. CHEN. Thin and thick film gas sensors. 99th Ann. Mtg., Amer. Ceram. Soc. (Cincinnati, Ohio, May 1997).
LIN, C. H., B. M. YEN, H. CHEN, T. B. WU, H. C. KUO, and G. E. STILLMAN. Characterization of highly textured PZT thin films grown on LaNiO3 coated Si substrate. Mater. Res. Soc. Fall Mtg. (Dec. 1997