Goddard, William

Monograph from CaltechTHESIS committee

• Musgrave, Charles Bruce, III (2025) Computational Approaches to Problems in Energy and Sustainability; 10.7907/hnc1-je90
• Mukasa, Daniel (2025) Computational Design of Wearable Chemical Sensors for Personalized Healthcare; 10.7907/r46k-sw73
• Glisman, Alec Gregory (2025) Part I: Multi-Valent Ion Effects on Polyelectrolyte Structure and Thermodynamics & Part II: Hydrodynamic Self-Propulsion; 10.7907/gf6m-gs53
• Sun, Jiace (2025) Classical and Quantum Simulation of Chemical and Physical Systems; 10.7907/3qp8-q490
• Bruch, Dorian Wayne (2025) Theoretical Modeling of Interactions Between Electrolytes and Surfaces; 10.7907/eey8-et93
• Cusumano, Alexander Quinn (2024) Asymmetric Pericyclic Transformations from Reactive Palladium Intermediates; 10.7907/b0wn-wt67
• Korol, Roman (2024) Development and Applications of Imaginary Time Path Integral Methods; 10.7907/jy10-rf87
• Virgil, Kyle Allan (2024) Polarization-Resolved, Oblique Incidence Terahertz Spectroscopy of Highly Uniform 2D Hybrid Perovskite Films; 10.7907/cr97-p373
• Lu, Chen-Hsuan (2024) Strategic Advances in 2D Materials: Low-Temperature Plasma-Enhanced Chemical Vapor Deposition Growth of Graphene and Complementary Insights into MoS₂; 10.7907/cetf-ns02
• Böhme, Annette Ellen (2024) Observation of the Microenvironment Around CO₂ Reduction Electrodes via Fluorescent Confocal Laser-Scanning Microscopy; 10.7907/ceqb-ew84
• Jones, Gregory Harrison (2024) From Venus to Mars: Spectroscopy and Kinetics of Reactive Intermediates in Planetary Atmospheres; 10.7907/7010-fc76
• Cusumano, Alexander Quinn (2024) Asymmetric Pericyclic Transformations from Reactive Palladium Intermediates; 10.7907/b0wn-wt67
• Palfey, William Richard (2024) Hydrogen Incorporation in Rutile- and Perovskite-Structured Minerals and Their Analogues; 10.7907/nbyx-6446
• Michelsen, Jonathan Malte Zschiegner (2024) Measuring Charge Carrier and Structural Photodynamics at Solar Energy Material Surfaces Using Transient Extreme Ultraviolet Reflection Spectroscopy; 10.7907/73h7-kg35
• Grayson, Robert Wall (2024) Low-Energy Plasma–Surface Interactions at Airless Icy Bodies; 10.7907/fn7c-k591
• Lin, Haw-Wei (2024) Nonlinear and Multidimensional Terahertz Spectroscopy of Liquids and Crystalline Solids; 10.7907/2qt0-mg05
• Lawniczak, James Joseph (2023) Computational Investigations of Organometallic Catalysis; 10.7907/aepb-jm46
• Qiao, Zhuoran (2023) Physics-Informed Neural Approaches for Multiscale Molecular Modeling and Design; 10.7907/48d1-ja21
• Lucas, Éowyn (2023) Advancement of Asymmetric Bipolar Membranes for Tailoring Chemical Environments in Electrochemical Systems; 10.7907/jken-ty64
• Morla, Maureen Baradi (2023) Redox-Activated Covalent Functionalization of Semiconductor Surfaces; 10.7907/1exn-0t72
• Wang, Ziyi (2023) Temperature Dependence of Gas Physisorption Energy: Experimental and Computational Studies of Krypton on Porous Carbon
• Corona, Sydney Lea (2022) Emerging Evidence of a Second Glass Phase in Strong to Ultra-Fragile Bulk Metallic Glass-Forming Liquids; 10.7907/9bvb-2d78
• Saunders, Claire Nicole (2022) Thermal Behavior of Cuprous Oxide: a Comprehensive Study of Three-Body Phonon Effects and Beyond; 10.7907/mate-2v65
• Kim, Seungkyeum (2022) Development of Electrochemical Processes for More Practical and Effective Onsite Wastewater Treatment; 10.7907/ab1v-he77
• Loke, Samuel Pei Hao (2022) Photovoltaic Technologies Developed for Space-Based Solar Power; 10.7907/6jhy-2623
• Gu, Alan Yalun (2022) Aqueous Aerosols in Atmospheric Chemistry and Airborne Diseases; 10.7907/4spy-az88
• Corona, Sydney Lea (2022) Emerging Evidence of a Second Glass Phase in Strong to Ultra-Fragile Bulk Metallic Glass-Forming Liquids; 10.7907/9bvb-2d78
• Welch, Alexandra Justine (2022) Understanding and Optimizing the Local Catalyst Environment in CO₂ Reduction Electrodes; 10.7907/4s78-cq55
• Cheng, Lixue (2022) Accurate and Transferable Molecular-Orbital-Based Machine Learning for Molecular Modeling; 10.7907/cjak-4x38
• Chen, Yalu (2021) Computational Investigation of Nanoscale Electrocatalysts for Clean Energy Conversion; 10.7907/tgw8-c485
• Buabthong, Pakpoom (Pai) (2021) Stability and Protective Coatings of Semiconductor Electrodes for Solar Fuel Devices; 10.7907/dx7s-fh20
• Bagley, Jacob David (2021) Fabrication of Pristine and Doped Graphene Nanostripes and their Application in Energy Storage; 10.7907/hfdw-fs13
• Ford, Rachel Rae (2021) Controlling the Dynamics of Microstructure Formation in Mixed-Matrix Polymeric-Particle Membranes; 10.7907/fqgq-vd04
• Lee, Kyra SoHyun (2021) 2-D Material Sensors on the Electronic Nose for the Sensitive Detection of VOCs; 10.7907/j5e1-k535
• Cheng, Wen-Hui (Sophia) (2020) Towards High Solar to Fuel Efficiency: From Photonic Design, Interface Study, to Device Integration; 10.7907/kd6a-xt88
• Giwa, Adenike Monsurat (2019) Microstructure and Small-Scale Deformation of Al₀.₇CoCrFeNi High-Entropy Alloy; 10.7907/PSWX-RY20
• Yalamanchili, Sisir (2019) Light Management in Photovoltaics and Photoelectrochemical Cells using Tapered Micro and Nano Structures; 10.7907/RRYM-VK03
• Huang, Yufeng (2019) Computational Heterogeneous Electrochemistry – From Quantum Mechanics to Machine Learning; 10.7907/MCGV-Y790
• Qian, Jin (2019) From Quantum Mechanics to Experimental Observables: Computational Investigations of Energy-Related Heterogeneous Catalysts; 10.7907/SPEJ-5X35
• Jhalani, Vatsal A. (2019) Light Emission and Ultrafast Carrier Dynamics in III-V Semiconductors from First Principles; 10.7907/9E0D-KX54
• Paik, Haemin (2019) Development of Electrocatalysts in Solid Acid Fuel Cells; 10.7907/C96K-Z389
• Jiang, Jingjing (2018) Interfacial and Stability Studies of Photocathodes for Hydrogen Evolution; 10.7907/SBJ9-D062
• Miller, Gregory Martin (2018) Eph Receptor Clustering by Chondroitin Sulfate Inhibits Axon Regeneration; 10.7907/Z9RJ4GPT
• Cid, Clément Antoine François (2018) Development, Implementation, and Improvements on an Effective Electrochemical Wastewater Treatment and Recycling Unit as a Sustainable Sanitation Solution for the Developing World; 10.7907/Z9BG2M61
• Luo, Shi (2018) Microstructural Effects on Diffusion and Mechanical Properties in Different Material Systems; 10.7907/Z90G3HBV
• Niesen, Michiel Jacobus Maria (2018) Coarse-Grained Simulation Approaches for Protein Integration and Translocation via the Sec Translocon; 10.7907/Z91N7ZBS
• Zhou, Xinghao (2018) Performance and Stability Optimization of Solar Fuel Devices; 10.7907/SSNP-XW29
• Torelli, Daniel Anthony (2018) The Discovery of Novel Materials for the Electrocatalytic Reduction of Carbon Dioxide; 10.7907/RBD5-B141
• Yang, Kuang-Wei (2018) Synthesis, NMR Solution Structure, and Neuritogenic Activity of Chondroitin Sulfate D and E; 10.7907/TPD7-FB87
• Brooks, Daniel James (2018) Computational Investigation of Ionic Diffusion in Polymer Electrolytes for Lithium-Ion Batteries; 10.7907/ZE9T-V407
• Gethers, Matthew Leroy, III (2018) Therapeutic Opportunities and Approaches to Sequence Control for Nucleic Acids; 10.7907/WE1E-EZ49
• Liang, JingXin (2018) Interrogating the Structural Landscape of Malaria Biomarkers with Epitope Targeted Peptide Capture Agents; 10.7907/rxtr-6152
• Saadi, Fadl Hussein (2017) Acid-Stable Electrocatalysts for the Solar Production of Fuels; 10.7907/Z9QF8QV4
• Dong, Sijia S. (2017) First-Principles-Based Simulations for G Protein-Coupled Receptor Activation and for Large-Scale Nonadiabatic Electron Dynamics; 10.7907/Z98C9T8D
• Griffith, Adam Reid (2017) DarwinDock and GAG-Dock: Methods and Applications for Small Molecule Docking; 10.7907/Z91Z42GS
• Johnson, Samantha Jo Iva (2017) Computational Investigation of Small Molecule Catalysis by Cobalt, Rhodium, and Iridium Molecular Catalysts ; 10.7907/Z9TD9V9K
• Ji, Ho-Il (2017) Redox Kinetics of Nonstoichiometric Oxides; 10.7907/Z98913W2
• Verlage, Erik A. (2017) High-Efficiency Solar Fuel Devices: Protection and Light Management Utilizing TiO2; 10.7907/Z9MC8X2P
• Plymale, Noah Thomas (2017) Spectroscopic, Electronic, and Mechanistic Studies of Silicon Surfaces Chemically Modified with Short Alkyl Chains; 10.7907/Z9FF3QB1
• Roske, Christopher William (2017) Towards a Hydrobromic Acid Splitting Device Using Earth-Abundant Materials; 10.7907/Z9NS0RWS
• Murialdo, Maxwell Robert (2017) Anomalous Thermodynamics of Nonideal Gas Physisorption on Nanostructured Carbons; 10.7907/Z9GH9FXM
• Kaltenboeck, Georg (2016) Investigation of Capacitive Discharge Heating of Metallic Glasses; 10.7907/Z9251G5Z
• Bajaj, Saurabh (2016) Phase Diagrams and Defect Thermodynamics to Devise Doping Strategies in Lead Chalcogenide Thermoelectric Materials and its Alloys; 10.7907/Z9DF6P6N
• Kaltenboeck, Georg (2016) Investigation of Capacitive Discharge Heating of Metallic Glasses; 10.7907/Z9251G5Z
• Chen, David Zhaoyue (2016) Atomic-Level Structure and Deformation in Metallic Glasses; 10.7907/Z95Q4T2B
• Crowley, Jason Michael (2016) Resolution of the Band Gap Prediction Problem for Materials Design; 10.7907/Z9D21VKZ
• Shing, Amanda M. (2016) Development of Zn-IV-Nitride Semiconductor Materials and Devices; 10.7907/Z94Q7RXJ
• Kim, Hyun-Sik (2016) Thermoelectric Properties of Bismuth Antimony Telluride Alloys; 10.7907/Z9RN35V0
• Tang, Yinglu (2016) Thermoelectric Skutterudites: Why and How High zT Can Be Achieved; 10.7907/Z9TD9VB1
• Liu, Fan (2016) Classical Force Field Simulations of Biological Processes and Quantum Chemical Computations of Homogeneous Catalysts; 10.7907/Z94M92J2
• Ji, Chenguang (2015) Design of Antenna-Coupled Lumped-Element Titanium Nitride KIDs for LongWavelength Multi-Band Continuum Imaging; 10.7907/Z9W66HQ7
• Cho, Kangwoo (2015) Wastewater Electrolysis Cell for Environmental Pollutants Degradation and Molecular Hydrogen Generation ; 10.7907/Z9DZ0676
• Yang, Chih-Kai (2015) An Exploration of Perovskite Materials for Thermochemical Water Splitting; 10.7907/Z91834GB
• Kameel, Fathima Rifkha (2015) Oxidation of Volatile Organic Compounds in Aqueous Solution and at the Air-water Interface of Aqueous Microdroplets; 10.7907/Z9MP5174
• Hong, Qi-Jun (2015) Methods for Melting Temperature Calculation; 10.7907/Z98C9T6H
• Aryanfar, Asghar (2015) Dendrites Inhibition in Rechargeable Lithium Metal Batteries; 10.7907/Z9ZK5DMP
• Kirkpatrick, Andrea (2015) Computational Predictions of G Protein-Coupled Receptor Structures and Binding Sites; 10.7907/Z9NG4NJG
• Barnes, Taylor Arnold (2015) Development and Application of Embedding Methods for the Simulation of Large Chemical Systems; 10.7907/Z9KK98P1
• Aitken, Zachary Howard (2015) Effect of Microstructural Interfaces on the Mechanical Response of Crystalline Metallic Materials; 10.7907/Z9C24TCP
• Cvicek, Vaclav (2015) Structure Prediction of G-Protein Coupled Receptors; 10.7907/Z9S46PVG
• Xiao, Hai (2015) First Principles Based Multiparadigm Modeling of Electronic Structures and Dynamics; 10.7907/Z94747T1
• Lam, Yan Choi (2015) Synthesis, Oxidation and Photophysics of Perfluoroborated Tetrakis(pyrophosphito)diplatinate (II) and Density Functional Theory (DFT) Study of Electrochemical CO2 Reduction by Mn Catalysts; 10.7907/Z94J0C2D
• Tsai, Ho-Cheng (2015) Quantum Mechanics Studies of Fuel Cell Catalysts and Proton Conducting Ceramics with Validation by Experiment; 10.7907/Z9P55KFW
• Narang, Prineha (2015) Light-Matter Interactions in Semiconductors and Metals: From Nitride Optoelectronics to Quantum Plasmonics; 10.7907/Z9513W4S
• Lan, Tian (2014) Studies of Phonon Anharmonicity in Solids; 10.7907/AB7A-FP25
• Chitsaz, Mohsen (2014) Protein Structure Refinement Algorithms; 10.7907/7731-QM74
• Fu, Ross (2014) Iridium and Rhodium Analogues of the Shilov Cycle Catalyst; and The Investigation and Applications of the Reduction-Coupled Oxo Activation (ROA) Mechanistic Motif towards Alkane Upgrading; 10.7907/WY3F-DZ94
• Gleason-Rohrer, David Charles (2014) Measurement of the Band Bending and Surface Dipole at Chemically Functionalized Si(111)/Vacuum Interfaces; 10.7907/PD7F-P488
• Liu, Wei-Guang (2014) First-Principle Studies of the Initiation Mechanism of Energetic Materials; 10.7907/Z9445JGM
• Goodpaster, Jason Daniel (2014) Density Functional Theory Embedding for Correlated Wavefunctions; 10.7907/RX3S-GH65
• Scott, Caitlin Eileen (2014) Role of Conformational Changes in G Protein-Coupled Receptor Activation; 10.7907/Z94747VG
• Wei, Wei (2014) Microfluidics-Based Single-Cell Functional Proteomics Microchip for Portraying Protein Signal Transduction Networks within the Framework of Physicochemical Principles, with Applications in Fundamental and Translational Cancer Research; 10.7907/Z9WS8R7G
• Jeon, Seokmin (2014) Structure, Chemistry, and Energetics of Organic and Inorganic Adsorbates on Ga-rich GaAs and GaP(00l) Surfaces; 10.7907/1T2B-J793
• Liu, Xiao (2014) A Study on Iron-Based Amorphous Alloys: Alloy Development, Thermodynamics and Soft Magnetism; 10.7907/X2WM-RA54
• Varga, Aron (2013) Advancing Electrocatalysis in Solid Acid Fuel Cells; 10.7907/Z9RX992C
• Hwang, Kiwook (2013) Biotechnologies for Cancer Diagnostics: Cell Sorting, Protein Analysis and Imaging of Cellular Metabolism; 10.7907/Z6DN-0483
• Ma, Chao (2013) Single Cell Proteomics Microchip to Profile Immune Function, with Applications in Stem Cell Biology, Translational Disease Mechanism Study and Clinical Therapeutics Monitoring; 10.7907/2M7E-0P25
• Garrett, Glenn Robert (2013) Study of the Origins of Toughness in Amorphous Metals; 10.7907/Z9JD4TRM
• Pomrehn, Gregory Schoelerman (2013) Phase Stability and Defect Behavior in Complex Thermoelectric Zinc-Antimonides; 10.7907/0AWH-4P69
• Kurji, Zuleikha (2013) Molecular Design of Side-Group Liquid Crystalline Polymers: Understanding Their Interactions with Small Molecule Liquid Crystal Solvent; 10.7907/Z9WH2N6R
• Stadie, Nicholas P. (2013) Synthesis and Thermodynamic Studies of Physisorptive Energy Storage Materials; 10.7907/ZK3P-CV60
• Jang, Min Seok (2013) Plasmonics and Electron Optics in Graphene; 10.7907/59RB-9653
• Mishra, Himanshu (2013) Proton Transfers at the Air-Water Interface; 10.7907/A9HR-PN89
• Muñoz, Jorge Alberto (2013) Electronic Structure and Phonon Thermodynamics of Iron Alloys; 10.7907/7EJD-RP70
• Yu, Jen-Kan (2012) Nanostructured Silicon Thermoelectrics; 10.7907/HPEF-BM21
• Tadross, Pamela Michele (2012) Exploiting the Reactivity of Arynes in the Total Synthesis of Natural Products; 10.7907/0HAZ-QF41
• Theofanis, Patrick Lauren (2012) The Quantum Electron Dynamics of Materials Subjected to Extreme Environments; 10.7907/BJ5N-QV45
• Li, Chen W. (2012) Phonon Anharmonicity of Ionic Compounds and Metals; 10.7907/7VS5-0F52
• Yu, Ted H. (2012) Degradations and Improvements in PEM Fuel Cell Materials: A Computational Study ; 10.7907/0CYM-2B74
• An, Qi (2012) Atomistic Simulations of Material Properties under Extreme Conditions; 10.7907/E3Z0-1A27
• Cheng, Mu-Jeng (2012) Mechanistic Insights into Alkane C-H Activation and Functionalization by Metal Oxide Surfaces and Organometallic Complexes; 10.7907/K4XH-V434
• Mendoza-Cortes, Jose Luis (2012) Design of Molecules and Materials for Applications in Clean Energy, Catalysis and Molecular Machines Through Quantum Mechanics, Molecular Dynamics and Monte Carlo Simulations; 10.7907/PQ74-HK88
• Ford, William Chastang (2012) I. Quantal Effects in Biochemical Cooperativity and a Proposed Mechanism for the Differentiation of Calcium Signaling in Synaptic Plasticity. II. Evolutionary Algorithms for the Optimization of Methods in Computational Chemistry; 10.7907/Z9HH6H1Z
• Tiwary, Pratyush (2012) Atomistic Simulations of Materials: Methods for Accurate Potentials and Realistic Time-Scales; 10.7907/J8W9-XS70
• Han, Si-ping (2011) DNA Directed Self-Assembly of Carbon Nanotube Structures; 10.7907/3ZN9-T618
• Brown, Evan Cornell (2011) Electrochemically Deposited Ceria Structures for Advanced Solid Oxide Fuel Cells; 10.7907/93NE-TG09
• Walker, Don (2011) Corrole Sensitized Solar Cells; 10.7907/XQBW-D585
• Louie, Mary W. C. (2011) Electrocatalysis in Solid Acid Fuel Cells; 10.7907/1HK1-2M22
• Sha, Yao (2011) The Mechanisms of the Fuel Cell Oxygen Reduction Reaction on Pt and Other 8-11 Column Metal Surfaces; 10.7907/7VD4-FY21
• Liu, Yu (2010) Biochemical Reactions in Confined Space; 10.7907/W9H8-8T44
• Fisher, Daniel Ross (2010) Development and Applications of Quantum Monte Carlo; 10.7907/4YCS-9T88
• Cable, Morgan Leigh (2010) Life in Extreme Environments: Lanthanide-Based Detection of Bacterial Spores and Other Sensor Design Pursuits; 10.7907/0NFE-Y329
• Wang, Ying (2010) Equilibrium ²H/¹H Fractionations in Organic Molecules ; 10.7907/4MPX-MF10
• Pascal, Tod Augustin (2010) New Approaches to Accurate Predictions of Free Energies: From Proteins to Organic Nanostructures; 10.7907/P0JH-QM60
• Bray, Jenelle Kiara (2010) The Development and Application of Computational Methods for the Prediction of G Protein-Coupled Receptor Structures; 10.7907/1655-ES74
• Mueller, Jonathan Edward (2010) Structures, Energetics and Reactions of Hydrocarbons on Nickel; 10.7907/RVXX-Z341
• Anderson, Amos Gerald (2010) Quantum Monte Carlo: Faster, More Reliable, and More Accurate; 10.7907/KVTV-N754
• Sheriff, Bonnie Ann (2009) Silicon Nanowires and Silicon/Molecular Interfaces for Nanoscale Electronics; 10.7907/Q13E-NB40
• Torrice, Michael McCann (2009) Chemical-Scale Studies of the Nicotinic and Muscarinic Acetylcholine Receptors; 10.7907/4WKT-NB09
• Tanrikulu, Ismet Çag˘ler (2009) Discovery of Aminoacyl-tRNA Synthetase Mutants for the Incorporation of Non Canonical Amino Acids into Proteins; 10.7907/E7D5-HN96
• Matsuda, Yuki (2009) Ab Initio Quantum Mechanical Studies in Electronic and Structural Properties of Carbon Nanotubes and Silicon Nanowires; 10.7907/7FXD-ZQ68
• Kim, Hyungjun (2009) Multiscale and Multiphysics Computational Frameworks for Nano- and Bio-Systems; 10.7907/0PFF-R531
• Hanek, Ariele Patrice (2009) Chemical-Scale Investigations of Cys-Loop Neurotransmitter Gated Ion Channels; 10.7907/FSYX-Y861
• Kekenes-Huskey, Peter Michael (2009) A Monte Carlo-Based Torsion Construction Algorithm for Ligand Design; 10.7907/A1MQ-3116
• Alabi, Christopher Akinleye (2009) I. Synthesis and Proton Conductivity Studies of Mesostructured Organosilicates and Bitriazole-Polymer Composites. II. Targeted Nanoparticles for siRNA Delivery; 10.7907/9SNH-2A91
• Wiencko, Heather L. (2009) Adrenergic Receptors: Model Systems for Investigation of GPCR Structure and Function; 10.7907/S3RC-RZ59
• Li, John Jian-Zhong (2009) Study of Liquid Metals by Electrostatic Levitation; 10.7907/JY7J-Q837
• Shapiro, Ian Ross McKay (2009) Observation of Single-Molecule Rotational Diffusion at Microsecond Timescale by Polarized Fluorescence Correlation Spectroscopy; 10.7907/KVDR-9429
• Keith, Jason M. (2008) Palladium Mediated Activation of Molecular Oxygen; 10.7907/K4AY-P498
• Boukai, Akram Issam (2008) Thermoelectric Properties of Bismuth and Silicon Nanowires; 10.7907/QEE9-4H11
• Jordan, Jason Paul (2008) The Development of Water-Soluble Olefin Metathesis Catalysts Containing an N-Heterocyclic Carbene Ligand; 10.7907/B57A-ZS49
• Ayalasomayajula, Meher Kiran Prakash (2008) Theoretical Studies of Single Molecule Biophysical Systems and Photochemical Ensembles; 10.7907/5D2K-7H81
• Tong, Chinghang (2008) Thermodynamic Modeling of Organic Aerosol; 10.7907/3M7R-9620
• Caspi, Daniel David (2008) The Adaptive Nature of Palladium Reactivity in Synthesis; 10.7907/N37A-5970
• Kam, Victor Wai Tak (2008) Methods in Computational Protein Design; 10.7907/S7KW-0M44
• Lind, Mary Laura (2008) Ultrasonic Investigation of the Elastic Properties and Liquid Fragility of Bulk Metallic Glasses in the Supercooled Liquid Region; 10.7907/3B4B-ZV48
• Tsai, Sherry Mon-Yue (2008) Alpha-Diaminobutyric Acid-Linked Hairpin Polyamide-Alklylator Conjugates ; 10.7907/3S8Y-YD79
• McFadden, Ryan Michael (2008) Applications of Palladium-Catalyzed Enantioselective Decarboxylative Alkylation in Natural Products Total Synthesis; 10.7907/GQ1E-RW28
• Keith, John Andrew (2008) Computational Insight into Homogeneous Organopalladium Catalysis; 10.7907/FAS9-DV26
• Duan, Gang (2008) Simulations, Modeling, and Designs of Bulk Metallic Glasses; 10.7907/ZH3G-JF43
• Dodd, Joanna Lynn (2007) Phase Composition and Dynamical Studies of Lithium Iron Phosphate; 10.7907/0B7N-ZF63
• Green, Jonathan Earl (2007) Ultra-Dense Nano- and Molecular-Electronic Circuits; 10.7907/HCQH-2S48
• Lee, Lori Wai Hang (2007) Chemical Scale Investigations of the Gating Mechanism of Ion Channels; 10.7907/bv54-5p15
• Cowan, Lisa (2007) Superprotonic Solid Acid Phase Transitions and Stability; 10.7907/30RE-XG95
• Su, Julius Tsu-li (2007) An Electron Force Field for Simulating Large Scale Excited Electron Dynamics; 10.7907/d8a3-e876
• Niemer, Rachel K. (2007) Computational Studies of the Structure and Function of Two Lipid-Activated G Protein-Coupled Receptors; 10.7907/djy6-nw49
• Heo, Jiyoung (2007) Computational Studies of Orphan G Protein-Coupled Receptors; 10.7907/rmmr-sj52
• Liu, Jian (2007) Microfluidic Devices for Genetic Analysis and Gene Expression Studies; 10.7907/xnm0-4a75
• Harmon, John Shelby, III (2007) Experimental Studies of Elasticity, Plastic Flow, and Anelasticity in Metallic-Glass-Forming-Liquids; 10.7907/53AD-3G15
• Behenna, Douglas Carl (2007) Progress Toward the Synthesis of (+)-Zoanthenol and the Development of an Asymmetric Tsuji Allylation Reaction; 10.7907/46KF-QE46
• Delaire, Olivier (2006) The Phonon Entropy of Transition Metals and Alloys: Effects of Impurities and of a Martensitic Phase Transition; 10.7907/SDJF-E025
• Choi, Eun Jung (2006) Development and Applications of Computational Protein Design; 10.7907/ZNED-BV38
• Lu, Connie Chih (2006) The Chemistry of Tris(phosphino)borate Manganese and Iron Platforms; 10.7907/0DND-1J03
• Mu, Tingwei (2006) A Chemical-Scale Study on the Ligand-Binding Site of a Serotonin-Gated Ion Channel; 10.7907/VSEF-4856
• Solares, Santiago de Jesus (2006) Multi-Scale Simulations of Single-Walled Carbon Nanotube Atomic Force Microscopy and Density Functional Theory Characterization of Functionalized and Non-Functionalized Silicon Surfaces; 10.7907/XZR1-C472
• Biteen, Julie Suzanne (2006) Plasmon-Enhanced Silicon Nanocrystal Luminescence for Optoelectronic Applications; 10.7907/B77G-WS08
• Thurman, Derek Wade (2006) Molecular Aspects of Flow-Induced Crystallization of Polypropylene; 10.7907/wew1-af68
• Rutenberg, Isaac Michael (2005) Functionalized Polymers and Surfaces via Ring-Opening Metathesis Polymerization; 10.7907/5Z6Y-G191
• Dirks, Robert Michael (2005) Analysis, Design, and Construction of Nucleic Acid Devices; 10.7907/VZ43-FM66
• Sharma, Shantanu (2005) Prediction of Structure and Antagonist Binding Site in Human and Rodent Chemokine Receptor 1; 10.7907/j4zd-ny21
• Petersson, Ernest James (2005) Investigations of Ion Channel Structure and Function. I. Studies of Nicotine Binding to the Acetylcholine Receptor. II. Development of Tools for Studying Learning and Memory with Unnatural Amino Acids; 10.7907/yhty-re87
• Staneff, Geoffrey D. (2005) High-Pressure Synthesis of Thermoelectric Materials; 10.7907/HWWN-NS80
• Hall, Spencer Eugene (2005) Development of a Structure Prediction Method for G-Protein Coupled Receptors; 10.7907/JN28-5F55
• Xu, Donghua (2005) Development of Novel Binary and Multi-Component Bulk Metallic Glasses; 10.7907/XD2M-WW51
• Xu, Donghua (2005) Development of Novel Binary and Multi-Component Bulk Metallic Glasses; 10.7907/XD2M-WW51
• Benitez, Diego (2005) Theoretical Study of the Mechanism of Olefin Metathesis and Synthesis of Cyclic Polymers; 10.7907/eas9-x408
• Peng, Joyce Yaochun (2005) Structure and Function Prediction of Human Muscarinic Acetylcholine Receptor 1, Cation-π Studies, and Protein Design; 10.7907/XVJR-RN32
• Nielsen, Robert J. (2005) Computational Strategy in Catalyst Design; 10.7907/60VH-AQ40
• Mukherjee, Sundeep (2005) Study of Crystallization Behavior, Kinetics and Thermodynamics of Bulk Metallic Glasses Using Noncontact Electrostatic Levitation Technique; 10.7907/33FY-8482
• Sisk, Brian Christopher (2005) Computational Optimization of Chemical Vapor Detector Arrays; 10.7907/Z3K5-C749
• Zhang, Qingsong (2005) Atomistic Simulation of Barium Titanate; 10.7907/SQ9J-4H73
• Wu, Jian (2005) Defect Chemistry and Proton Conductivity in Ba-based Perovskites; 10.7907/VTCG-T978
• Li, Youyong (2005) Atomistic Simulation of Macromolecules; 10.7907/NW1Q-1E81
• Scherman, Oren Alexander (2004) Enhancing Materials Through Controlled Architectures with Ring-Opening Metathesis Polymerization; 10.7907/E1BS-HG72
• Kalani, M. Yashar S. (2004) Structure and Function Studies of the Human Dopamine Receptors; 10.7907/T6NV-7W30
• Mayo, Elizabeth Idonia (2004) Kinetics and Thermodynamics of Dye (Group VIII Metal)–Sensitized Nanocrystalline Titanium Dioxide Photoelectrodes; 10.7907/E9WY-1N05
• Deng, Wei-Qiao (2004) Computation Aided Design in Molecular Nanotechnology; 10.7907/3EKY-3J53
• Boysen, Dane Andrew (2004) Superprotonic Solid Acids: Structure, Properties, and Applications; 10.7907/41BQ-3R07
• Wang, Pin (2004) Expanding the Biosynthetic Capacity of the Aminoacyl-tRNA Synthetases; 10.7907/99W6-8F08
• Elmore, Donald Eugene, Jr. (2004) Investigations of Ion Channel Structure-Function Relationships Using Molecular Modeling and Experimental Biochemistry; 10.7907/47GW-HT46
• Trabanino, Rene Jouvanni (2004) Prediction of Structure, Function, and Spectroscopic Properties of G-Protein-Coupled Receptors: Methods and Applications; 10.7907/VHED-4063
• Mason, Maribeth Swiatek (2004) Synthesis of Large-Grained Polycrystalline Silicon by Hot-Wire Chemical Vapor Deposition for Thin Film Photovoltaic Applications; 10.7907/7K9R-VX22
• Gstrein, Florian (2004) Electron-Transfer Processes at Semiconductor/Liquid Interfaces and Metal/Nanogap Junctions; 10.7907/1NT2-FB12
• Bielawski, Christopher William (2003) Tailoring Polymer Synthesis with Designer Ruthenium Catalysts; 10.7907/X0T4-9940
• Meier, Alexandre Edouard (2003) Gallium and Chromium Corroles; 10.7907/JAKV-8V97
• Datta, Deepshikha (2003) Protein-Ligand Interactions: Docking, Design and Conformation Change; 10.7907/36FS-2262
• Lee, Hyon-Jee (2003) Molecular Dynamics Studies of Metallic Glasses; 10.7907/ZE5V-VZ33
• Kent, David Randall, IV (2003) New Quantum Monte Carlo Algorithms to Efficiently Utilize Massively Parallel Computers; 10.7907/V64A-V618
• Zhang, Deqiang (2003) Structure-Based Design of Mutant Proteins: I. Molecular Docking Studies of Amino Acid Binding to Wild-Type Aminoacyl-tRNA Synthetases. II. Structure-Based Design of Mutant Aminoacyl-tRNA Synthetases for Non-Natural Amino Acid Incorporation; 10.7907/CN3G-JH45
• Chisholm, Calum Ronald Inneas (2003) Superprotonic Phase Transitions in Solid Acids: Parameters Affecting the Presence and Stability of Superprotonic Transitions in the MHₙXO₄ Family of Compounds (X=S,Se,P,As; M=Li,Na,K,NH₄,Rb,Cs); 10.7907/FYTW-7G64
• Zamanakos, Georgios (2002) A Fast and Accurate Analytical Method for the Computation of Solvent Effects in Molecular Simulations; 10.7907/B7W8-N760
• Bolon, Daniel N. (2002) Computational Enzyme Design; 10.7907/W7F3-DS14
• Sobrero, Aquiles Carlos (2002) Surface Structure Determination by Low-Energy Electron Diffraction; 10.7907/9b54-km20
• Sobrero, Aquiles Carlos (2002) Surface Structure Determination by Low-Energy Electron Diffraction; 10.7907/9b54-km20
• Bogdanoff, Peter David (2002) The Phonon Entropy of Metals and Alloys: The Effects of Thermal and Chemical Disorder; 10.7907/045G-6426
• Wang, Guofeng (2002) First Principles Based Multiscale Modeling of Single Crystal Plasticity: Application to BCC Tantalum; 10.7907/5nyn-ct36
• Amashukeli, Xenia (2002) Electron-Transfer Reorganization Energies of Isolated Molecules
• Feldmann, Michael Todd (2002) Quantum Monte Carlo: Quest to Get Bigger, Faster, and Cheaper; 10.7907/4D4F-WZ34
• Feldmann, Michael Todd (2002) Quantum Monte Carlo: Quest to Get Bigger, Faster, and Cheaper; 10.7907/4D4F-WZ34
• Szczepankiewicz, Steven Henry (2001) Surface Chemistry of TiO₂ Photocatalysts; 10.7907/HABJ-3T48
• Kua, Jeremy Soo Pin (2001) Computational Studies of Heterogeneous and Homogeneous Catalysis by Late Transition Metals; 10.7907/M9WN-7M53
• Brandow, Christopher Graham (2001) Zirconocenes as Models for Homogeneous Ziegler-Natta Olefin Polymerization Catalysts; 10.7907/kxb2-wp19
• Chang, Aileen Yulin (2001) Cleavage of DNA by Polamide-Seco-CB1 Conjugates; 10.7907/FY0F-DW57
• Szczepankiewicz, Steven Henry (2001) Surface Chemistry of TiO₂ Photocatalysts; 10.7907/HABJ-3T48
• Manley, Michael Edward (2001) From Elementary Excitations to Microstructures: the Thermodynamics of Metals and Alloys Across Length Scales; 10.7907/WECC-4662
• Qi, Yue (2001) Molecular dynamics (MD) studies on phase transformation and deformation behaviors in FCC metals and alloys; 10.7907/9NXP-E603
• Debe, Derek Anthony (2001) Shaving Levinthal with Occam's Razor: Understanding the Rate Limiting Step in Protein Folding; 10.7907/p4yc-y834
• Carlson, Matt Jeffrey (2000) BUFF: A Biological Universal Forcefield Derived from Quantum Mechanics; 10.7907/5kyh-4402
• Lu, Daqi (2000) Theoretical Studies of the Nonlinear Optical Properties of Organic Materials; 10.7907/myx9-7278
• Kirkland, Thomas Andrew (2000) Expanding the Applications of Transition Metal Alkylidenes and Alkylidynes to Organic Synthesis; 10.7907/w770-7r65
• Scholl, Matthias (2000) Expanding the Scope of Ruthenium-Based Olefin Metathesis Catalysts; 10.7907/55x3-h359
• Morgan, Chantal Smith (2000) Full Sequence Design of an Alpha-Helical Protein and Investigation of the Importance of Helix Dipole and Capping Effects in Helical Protein Design; 10.7907/8wn3-cv27
• Miller, Stephen Albert (2000) Metallocene-mediated olefin polymerization : the effects of distal ligand perturbations on polymer stereochemistry; 10.7907/51r0-km07
• Carlson, Matt Jeffrey (2000) BUFF: A Biological Universal Forcefield Derived from Quantum Mechanics; 10.7907/5kyh-4402
• Wilhelm, Thomas Edward (1999) Easier and More Efficient Methods for the Generation of Metathesis Catalysts: Investigations into Group VI and VII; 10.7907/3d4p-py55
• Claypool, Christopher L. (1999) Why molecules look the way they do in STM : a systematic functional group approach; 10.7907/AAWF-HM84
• Wilhelm, Thomas Edward (1999) Easier and More Efficient Methods for the Generation of Metathesis Catalysts: Investigations into Group VI and VII; 10.7907/3d4p-py55
• Faglioni, Francesco (1998) Quantum chemical computations of heterogeneous selective oxidation, STM images, and multiple bond reactions; 10.7907/ksr7-qk84
• Kuwata, Keith Tadao (1998) Spectroscopic and Computational Studies of Ionic Clusters as Models of Solvation and Atmospheric Reactions; 10.7907/27ng-zt31
• Dahiyat, Bassil I. (1998) Protein design automation : principles and practice; 10.7907/08j5-w532
• Ramirez, Benjamin E. (1998) The CUₐ center of cytochrome oxidase : electronic structure calculations and electron-tunneling pathways; 10.7907/r7t8-xt78
• Belmares, Michael Paul (1998) Molecular Origins of the Thermophysical Properties of Polymers and Modeling of Polymer Permeation by Large Molecules; 10.7907/vnw1-8367
• Gao, Guanghua (1998) Large Scale Molecular Simulations with Application to Polymers and Nano-Scale Materials; 10.7907/69rm-7y79
• Zuercher, William John (1998) Ruthenium-Catalyzed Polycyclization Reactions; 10.7907/2857-9b48
• Iotov, Mihail S. (1998) Diffusion in Amorphous Media; 10.7907/9b0m-2j57
• Melnik, M. Susan (1997) Diamond surfaces : interactions with hydrogen and halogens; 10.7907/gdrt-7n92
• Herzog, Timothy Allan (1997) Deuterium Isotope Effects as Evidence for α-Agostic Assistance in Ziegler-Natta Catalysts. Design, Synthesis, and Reactivity of a New Class of Highly Syndiospecific Ziegler-Natta Polymerization Catalysts; 10.7907/tv4y-w681
• McClurg, Richard Beatty (1997) Homogeneous nucleation theory; 10.7907/Z011-9767
• Crellin, Kevin Christopher (1997) The investigation of gas-phase ion-molecule reactions with fourier transform ion cyclotron resonance mass spectrometry; 10.7907/p8bs-x927
• Tsai, Bao-Liang (1997) First principles studies of semiconductor epitaxial growth; 10.7907/2CV3-2A62
• Blake, Robert Edward, Jr. (1996) The Synthesis, Characterization and Study of Transition Metal Complexes for the Oxidation and Activation of Hydrocarbons; 10.7907/s731-np77
• Johnson, Matthew Stanley (1996) Spectroscopy of Reactive Molecules and Clusters; 10.7907/ta23-4185
• Demiralp, Ersan (1996) Prediction of structures and properties for organic superconductors; 10.7907/7p7g-sm17
• Kelly, James J. (1996) Binding site size limitations of imidazole-pyrrole polyamides for recognition in the minor groove of DNA; 10.7907/jc2t-pr07
• Claverie, Jérôme (1996) Ring-Opening Metathesis Polymerization with Tungsten Based Catalysts: Kinetics, Thermodynamics and Mechanism; 10.7907/h6fj-1t43
• Heikal, Ahmed Abdou (1996) Ultrafast molecular dynamics in complexed trans-stilbene; 10.7907/p3gz-kj57
• Gerdy, James Joseph (1996) Accurate Interatomic Potentials for Simulations; 10.7907/g2gs-kv14
• Colocci, Natalia (1996) Cooperative Oligonucleotide-Directed Triple Helix Formation at Adjacent DNA Sites; 10.7907/08j6-sd37
• Hua, Xinlei (1996) First principles simulations : development of new density functionals and pseudopotentials and formation mechanism of fullerenes; 10.7907/r7qa-wt76
• Bierwagen, Erik Paul (1995) Computational Studies of Ziegler-Natta Catalysis and Concurrent Resonance Computations; 10.7907/3w1m-hk72
• Bierwagen, Erik Paul (1995) Computational Studies of Ziegler-Natta Catalysis and Concurrent Resonance Computations; 10.7907/3w1m-hk72
• Wang, Neng E. (1995) Studies in dynamics; 10.7907/j1ch-3v41
• Musgrave, Charles Bruce (1995) Molecular Mechanics and Ab Initio Simulations of Silicon (111) Surface Reconstructions, Semiconductors and Semiconductor Superlattices, H Abstraction for Nanotechnology, Polysilane, and Growth of CVD Diamond; 10.7907/7khv-pb17
• Lim, Kian-Tat (1995) Mega-molecular dynamics on highly parallel computers : methods and applications; 10.7907/e3qc-t131
• Li, Mo (1994) Crystal to Glass Transition and its Relation to Melting; 10.7907/a2hw-gm49
• Langlois, Jean-Marc (1994) New methods for ab initio quantum mechanical calculations in molecular and crystalline systems; 10.7907/j75s-5f43
• Miller, Ann Elizabeth (1993) Ab initio calculations in heterogeneous and homogeneous catalysis : I. Methanol to gasoline with ZSM-5. II. Carbonyl ligand effects on metal-metal bonds; 10.7907/WRBP-E952
• Baker, Shenda Mary (1992) Scanning Tunneling Microscopy and Spectroscopy of Silicon and Carbon Surfaces; 10.7907/5JGQ-4X60
• Chen, Guanhua (1992) Superconductivities of high-T_c materials and alkali compounds of Buckminsterfullerene; 10.7907/chz3-cq25
• Donnelly, Robert Edward (1992) Modeling and visualizing surfaces; 10.7907/1d15-vv30
• Sun, Yun (1992) NMR Studies of Protein-DNA Interactions: Determinations of DNA Structures Recognized by Bin Recombinase and Studies of Their Roles in Protein Binding Interactions; 10.7907/em1y-p761
• Tahir-Kheli, Jamil (1992) The infinite range Heisenberg model and high temperature superconductivity; 10.7907/9JDD-4P11
• Karasawa, Naoki (1992) Simulations of polymer crystals : new methods and applications; 10.7907/mjj7-qt65
• Baskin, John Spencer (1990) Real-Time Observation and Analysis of Coherence and Alignment in Molecular Systems: Isolated Molecules and Chemical Reactions; 10.7907/H8TF-EE69
• Baskin, John Spencer (1990) Real-Time Observation and Analysis of Coherence and Alignment in Molecular Systems: Isolated Molecules and Chemical Reactions; 10.7907/H8TF-EE69
• Vogelaar, Nancy Swick (1989) Structural and Mechanistic Motifs in Membrane Proteins: The Three-Dimensional Modelling of Rhodopsin, Band 3, and the Nicotinic Acetylcholine Receptor; 10.7907/mgah-n841
• Lo, Davy (1989) Molecular Dynamics Simulation of Sputtering; 10.7907/EVKV-AW57
• Naylor, Adel Marie (1989) Insights on Enzymes and Polymers from Molecular Dynamics Simulations: Applications to Dihydrofolate Reductase Complexes and Starburst Dendrimers; 10.7907/0789-jw44
• Naylor, Adel Marie (1989) Insights on Enzymes and Polymers from Molecular Dynamics Simulations: Applications to Dihydrofolate Reductase Complexes and Starburst Dendrimers; 10.7907/0789-jw44
• Smith, David Charles (1989) Electronic Structure and Photochemical Reactivity of Binuclear Metal Complexes; 10.7907/q1gz-dn84
• Lo, Davy (1989) Molecular Dynamics Simulation of Sputtering; 10.7907/EVKV-AW57
• Shin, Seung Koo (1989) Experimental and Theoretical Studies of Silylenes, Silicenium Ions, and Organometallic Reactive Intermediates; 10.7907/sdj1-2y57
• Klavetter, Floyd L. (1989) Polyacetylene and Novel Conjugated Derivatives through the Metathesis Polymerization of 1,3,5,7-Cyclooctatetraenes; 10.7907/wqc2-mk42
• Klavetter, Floyd L. (1989) Polyacetylene and Novel Conjugated Derivatives through the Metathesis Polymerization of 1,3,5,7-Cyclooctatetraenes; 10.7907/wqc2-mk42
• Shin, Seung Koo (1989) Experimental and Theoretical Studies of Silylenes, Silicenium Ions, and Organometallic Reactive Intermediates; 10.7907/sdj1-2y57
• Pranata, Julianto (1989) Theoretical Studies of Novel Organic Systems: Biradicals, Polyradicals, and Conducting Polymers; 10.7907/x0ka-7s95
• Anlage, Steven Mark (1988) Icosahedral Order in Metastable Metallic Alloys; 10.7907/mjqp-qr45
• Sluka, James P. (1988) Design, Synthesis and Characterization of Sequence Specific DNA Cleaving Agents; 10.7907/4mj0-ec33
• Anslyn, Eric Van (1988) Mechanistic, Synthetic and Theoretical Studies of High Valent Metallacycles and metal Alkylidenes; 10.7907/m7kp-4g32
• Brusich, Mark John (1988) Theoretical Insights into the Bonding in Thorium Organometallic Complexes: A Comparison with Group IV Transition Metal Chemistry; 10.7907/89jn-7f38
• Petti, Michael Anthony (1988) Studies in Molecular Recognition; 10.7907/wvhj-nb98
• Klippenstein, Stephen Jacob (1988) Theoretical Studies of Chemical Reaction Dynamics; 10.7907/dbrd-wj15
• Swager, Timothy Manning (1988) Precursor Routes to Conducting Polymers from the Ring-Opening Metathesis Polymerization of Cyclic Olefins; 10.7907/KF6P-FC76
• Snyder, ‌Gary James (1988) 2,4-Dimethylene-1,3-Cyclobutanediyl and 2,4-Dimethylenebicyclobutane. Synthesis, Spectroscopy, and Reactivity of a Triplet Biradical and Its Covalent Isomer; 10.7907/4ftp-kr64
• Parmeter, John Ethan (1988) The Organometallic Chemistry of the Ru(001) Surface; 10.7907/xv82-qr39
• McAdon, Mark Herbert (1988) New Concepts of Metallic Bonding; 10.7907/jtpr-6m88
• Mayo, Stephen Leon (1988) Electron Transfer in Structurally Engineered Metalloproteins; 10.7907/YJKW-3133
• Holden, Peter James (1987) Extension Theorems for Functions of Vanishing Mean Oscillation; 10.7907/f7k9-rh88
• Schilling, Jerald Bruce (1987) Experimental and Theoretical Aspects of Hydrocarbon Activation by Transition Metal Ions in the Gas Phase; 10.7907/vazp-zt83
• Carter, Emily Ann (1987) Finesse in Quantum Chemistry: Accurate Energetics Relevant for Reaction Mechanisms; 10.7907/GVJQ-6Y71
• Onuchic, José Nelson (1987) New aspects of the theory of electron transfer reaction dynamics; 10.7907/hcep-rh59
• Tsai, Wilman (1987) Interactions of Ammonia with Platinum and Ruthenium Surfaces; 10.7907/4Y3N-2321
• Cheng, Yang-Tse (1987) Ion-Beam Mixing and the Formation of Amorphous Alloys; 10.7907/W1Y4-0347
• Cheng, Yang-Tse (1987) Ion-Beam Mixing and the Formation of Amorphous Alloys; 10.7907/W1Y4-0347
• Meinhart, James Douglas (1987) Synthesis and Reactivity of Titanocene Methylene Complexes and Bis(η⁵-Cyclopentadienyl) Titanacyclobutenes; 10.7907/16dt-2465
• Vajo, John J. (1987) Mechanistic Studies of Heterogeneously Catalyzed Reactions of Ammonia and Acetic Acid on Platinum Surfaces; 10.7907/vayx-4k53
• Jain, Rakesh (1987) Direct Observation and Reactions of Organic Biradicals Generated from Novel Bicyclic Azoalkanes; 10.7907/z16r-7e62
• Atzmon, Michael (1986) A Study of Bulk Amorphous Alloys Formed by Solid-State Reaction in Elemental Composites; 10.7907/5M6N-SK53
• Blake, Geoffrey A. (1986) On the Chemical Composition of Interstellar Molecular Clouds: A Millimeter and Submillimeter Spectral Line Survey of OMC-1; 10.7907/0F73-PJ76
• Hood, Diane Marie (1986) Calculation of e⁻-H Atom Scattering Processes using Hyperspherical Coordinates; 10.7907/xj5h-me61
• Hetzler, Steven Robert (1986) Infrared Optical Studies of HgTe-CdTe Superlattices and GaAs; 10.7907/5ptm-z449
• Hetzler, Steven Robert (1986) Infrared Optical Studies of HgTe-CdTe Superlattices and GaAs; 10.7907/5ptm-z449
• Gajda, Gregory Joseph (1986) An Inelastic Electron Tunneling Spectroscopic Investigation of Inorganic and Organometallic Molybdenum Complexes Adsorbed on Aluminum Oxide Surfaces; 10.7907/2evk-b965
• Cave, Robert J. (1986) A Theoretical Model for Orientation Effects in Electron Transfer Reactions; 10.7907/s9zp-mj05
• Tolbert, Margaret A. (1986) Mechanisms and Energetics of Alkane Activation by Transition Metal Ions in the Gas Phase; 10.7907/3047-z490
• Varney, Michael David (1986) Approach to the Synthesis of Chlorothricolide: Synthesis of (±)-19,20-Dihydro-24-O-methylchlorotricolide, methyl ester, ethyl carbonate; 10.7907/h9ke-rp15
• Atzmon, Michael (1986) A Study of Bulk Amorphous Alloys Formed by Solid-State Reaction in Elemental Composites; 10.7907/5M6N-SK53
• Low, John James (1985) Theoretical Studies of Oxidative Addition and Reductive Elimination; 10.7907/XR1N-CM33
• Hanratty, Maureen Alice (1985) Investigations of the Mechanisms and Energetics for Transition Metal Ion Mediated Reactions; 10.7907/6mqm-3w23
• Collins, Reuben Theodore (1985) Electronic Properties of Heterostructures and Defects in Compound Semiconductors; 10.7907/pg8h-k549
• Allison, Janet Noel (1985) Theoretical Studies of Heterogeneous Catalysis of Molybdates; 10.7907/wpmx-ff05
• Dolgin, Benjamin Paul (1985) Kinetics of the Formation of an Amorphous Layer During a Solid State Reaction; 10.7907/n0qt-h472
• Flanagan, Dorothy Jean (1985) The Angular Resolved Photoelectron Spectroscopy of Various Polyatomic Molecular Systems; 10.7907/f9mq-vz30
• Szuromi, Phillip David (1985) Studies of Hydrocarbon Reactions on Low-Index Iridium and Platinum Surfaces; 10.7907/ndxy-rb82
• Garvey, James F. (1985) The Production and Characterization of an Intense Hyperthermal Beam of H₃ Molecules and of H Atoms; 10.7907/r4n1-8762
• Hanratty, Maureen Alice (1985) Investigations of the Mechanisms and Energetics for Transition Metal Ion Mediated Reactions; 10.7907/6mqm-3w23
• Spies, George Harlan (1985) I. Studies on the Coordination of Bis-hydroxybenzamido Chelating Ligations to Chromium, Iron, and Osmium. II. A Survey of the Organometallic Chemistry of Osmium Tetraoxide; 10.7907/s19j-2033
• Winniczek, Jaroslaw W. (1985) Anisotropic Interaction Potentials between Helium and Linear Molecules from Crossed Beam Experiments; 10.7907/5nvw-ym37
• Fitzsimmons, Brian Joseph (1984) The Total Synthesis of the Enantiomer of Lasalocid A; 10.7907/w5gn-5650
• Winkler, Jay Richmond (1984) Spectroscopy and Photochemistry of Metal-Oxo Complexes; 10.7907/DE5E-2Y69
• McElwee-White, Lisa Ann (1984) Theoretical and Experimental Assessment of the Viability of 1,4,6,9-Spiro[4.4]Nonatetrayl as a Reactive Intermediate; 10.7907/nytz-bf09
• Mailhiot, Christian (1984) Theoretical Investigations of Electron States in Small-Scale Semiconductor Structures; 10.7907/0470-nf89
• Steigerwald, Michael Louis (1984) 2ₛ + 2ₛ Reactions at Transition Metals; 10.7907/S0HZ-TF05
• Zur, Amikam (1984) Theoretical Investigations of Solid Interfaces: 1. The Position of the Fermi Level at a Metal-Semiconductor Interface. 2. Geometric Lattice Match and Its Application to Heteroepitaxy. 3. Ab-Initio Calculation of the Elastic Properties of Silicon, Using Small Clusters; 10.7907/w8vp-2g07
• Goodgame, Marvin Mark (1984) Exchange Forces in Transition-Metal Bonding; 10.7907/xs72-nm31
• Gurer, Cigdem (1984) Time Dependent and Equilibrium Stress-Strain Behavior of Rubbers in Moderately Large Deformations; 10.7907/e0xe-8w83
• Baxter, David Verge (1984) EXAFS Studies of La-Ga Metallic Glasses; 10.7907/NHED-5T47
• Ennis, Michael Dalton (1983) I. Asymmetric Alkylation Reactions of Chiral Imide Enolates. II. Efforts Directed Toward the Total Synthesis of (+)-Macbecin I; 10.7907/pqm8-7286
• Duan, Daniel C. (1983) Evidence for a Stereospecific 1,2-Elimination Reaction in a 1,1-Diazene. Synthesis and Decomposition of [N-Phenyl-(Threo-(and Erythro)-2-Deuterio-1-Methylpropl)Amino]Nitrene; 10.7907/zbfn-1t36
• Daub, John Powell (1983) The Total Synthesis of Macrolide Antibiotics; 10.7907/87f1-5d52
• Speriosu, Virgil Simon (1983) X-ray Rocking Curve and Ferromagnetic Resonance Investigations of Ion-Implanted Crystals; 10.7907/BET3-1831
• Voter, Arthur Ford (1983) The Resonating Valence Bond Model of Molecules and Reactions; 10.7907/d754-h174
• Bowman, Robert Clark, Jr. (1983) Solid-State Proton Nuclear Magnetic Resonance Studies of Hydrogen Site Occupancies, Electronic Structure Properties, and Diffusion Behavior in Transition Metal Hydrides; 10.7907/w68b-2750
• McIntyre, Daniel Keith (1983) Synthesis and Characterization of 1,1-Di-Tert-Butyldiazene; 10.7907/y54d-s069
• Moody, Douglas Marion, Jr. (1983) I. Numerical Solution of the Superfluid Shock Jump Conditions. II. Experimental Investigation of the Liquid Helium II-Vapor Interface; 10.7907/387M-V435
• Kaye, Jack Alan (1982) Theoretical Studies of Chemical Reaction Dynamics; 10.7907/vkds-vb56
• Rianda, Ronald (1982) Electronic Transitions of Molecules by Electron Impact and Multiphoton Ionization Spectroscopy; 10.7907/b7ed-jg16
• Yocom, Kathryn Mary (1982) The Synthesis and Characterization of Inorganic Redox Reagent-Modified Cytochromes C; 10.7907/5tfv-gx02
• Maverick, Andrew William (1982) Spectroscopy and Photochemistry of Polynuclear Metal Complexes; 10.7907/PBEA-8W62
• Millar, David Philip (1982) Picosecond Studies of Molecular Energy Transfer, Reorientation, and Internal Motion Dynamics; 10.7907/NSA9-8028
• Wight, Charles Albert (1982) Chemical Applications of Infrared Laser Photochemistry; 10.7907/gskp-8c88
• Bair, Raymond Alan (1982) Part A. Theoretical Studies of the X-Ray Absorption Edge in Copper Complexes. Part B. Electron Correlation Consistent Calculation of Bond Dissociation Energies; 10.7907/ez8r-aj04
• Mitch, Charles Howard (1982) The Application of Metallated Enamines to the Synthesis of Morphine Alkaloids; 10.7907/vf0x-tn08
• Kuech, Thomas Francis (1981) Investigations of Schottky Barrier Structures in Compound Semiconductors: I. HgTe on CdTe: A Lattice Matched Schottky Barrier. II. Au-Cd Barriers to CdTe. III. Au Barriers on InₓGa₁₋ₓP; 10.7907/8hcw-7421
• Casewit, Carla Jutta (1981) I. Electrophilic Reactions of p-Toluenesulfonyl Azide. II. ¹⁵N and ¹³C Nuclear Magnetic Studies of Aryldiazonium Compounds Effect of Substituent, Solvent and 18-Crown-6; 10.7907/nyft-yr23
• Casewit, Carla Jutta (1981) I. Electrophilic Reactions of p-Toluenesulfonyl Azide. II. ¹⁵N and ¹³C Nuclear Magnetic Studies of Aryldiazonium Compounds Effect of Substituent, Solvent and 18-Crown-6; 10.7907/nyft-yr23
• Morse, Randall Heywood (1981) EPR Spectroscopic Studies of the Active Sites of Some Heme- and Copper-Containing, Oxygen-Binding Proteins; 10.7907/7cva-0k93
• Thiel, Patricia Ann (1981) Adsorption, Co-Adsorption and Catalytic Reactions on Rh(111) and Ru(001) Surfaces; 10.7907/8m9w-p414
• Highe, Albert John (1981) Ionic Motion in Solid Electrolytes: A Solid State NMR Study of Sodium and Lithium in β-Alumina; 10.7907/w0cr-8h87
• Berman, D. Wayne (1981) I. Thermochemistry and Reaction Kinetics of Disolvated Protons by Ion Cyclotron Resonance Spectroscopy. II. Thermochemical Studies of Small Fluorocarbons by Photoionization Mass Spectrometry; 10.7907/grqm-wy30
• Rappé, Anthony Kay (1981) Theoretical Studies of Homogeneous Catalysis by Transition Metal Complexes; 10.7907/8kc4-gq42
• Stevens, Amy Elizabeth (1981) Fundamental Studies of Reactive Intermediates in Organometallic Chemistry; 10.7907/XKHS-2M38
• Adler, George (1980) NMR Studies of Cooperativity in Hemoglobin; 10.7907/089e-bj69
• Adler, George (1980) NMR Studies of Cooperativity in Hemoglobin; 10.7907/089e-bj69
• Freiser, Ben Sherman (1977) Photochemical Investigations of Ions in the Gas Phase Utilizing Ion Cyclotron Resonance Spectroscopy; 10.7907/HMVE-Q508
• Freiser, Ben Sherman (1977) Photochemical Investigations of Ions in the Gas Phase Utilizing Ion Cyclotron Resonance Spectroscopy; 10.7907/HMVE-Q508