Goddard, William

Combined from CaltechTHESIS committee

• Jiang, Chenyu (2026) Tug of War between Epoxidation and Ketonization in Electrochemical Alkene Oxidation: Pulling the Rope for Ketonization; 10.7907/0fz2-1403
• Rezgui, Samir Peter (2026) Development of Synthetic Methods to Enable the Synthesis of Pyrroloiminoquinone Alkaloids; 10.7907/xmbz-by61
• Samkian, Adrian Eduard (2026) Total Synthesis of Hypersampsone M and Studies of Related Polycyclic Polyprenylated Acylphloroglucinol Systems; 10.7907/hd4h-sk15
• Nicolov, André (2026) A Song of Ice and Plasma: The Formation and Behavior of Ice-Dusty Plasmas, from the Laboratory to the Edge of the Universe; 10.7907/adns-n036
• Anderson, Robert Lon (2026) Methodological Development and Computational Investigations of Metal-Catalyzed Coupling Reactions; 10.7907/zr3d-vz73
• Anjum, Sara (2026) Towards Sustainable, Scalable, Low-Cost InP Space Solar Power; 10.7907/rhn1-n250
• Wilner, Oliver David (2026) Fluorinated Granitic Magmas: A Comprehensive Geochemical Study; 10.7907/pq7f-ad63
• Lee, Wonseok (2026) Unraveling Material Behavior with Electron and X-Ray Spectroscopies: From Transient Electronic Responses to Electronic Topological Transitions; 10.7907/q8yy-xb49
• Chen, Ruby Pengjui (2026) Synthesis of Stereoenriched Polycyclic Scaffolds via Palladium Enolates and Progress toward the Total Synthesis of Hypermoin A; 10.7907/war0-n433
• Strong, Christian Santiago (2026) Enantioselective Reactions of Palladium Enolates and Progress Toward Mitomycin B; 10.7907/gwac-qk95
• Li, Rui (2026) Efficient Evaluation of Coulomb Interactions for Large-Scale Quantum Chemistry; 10.7907/vj28-vh82
• Yu, Hao (2026) The Total Synthesis of Aleutianamine, (–)-Crotonolide D, and (–)-Crotonine G; 10.7907/cn84-6g19
• Glisman, Alec Gregory (2025) Part I: Multi-Valent Ion Effects on Polyelectrolyte Structure and Thermodynamics & Part II: Hydrodynamic Self-Propulsion; 10.7907/gf6m-gs53
• Bruch, Dorian Wayne (2025) Theoretical Modeling of Interactions Between Electrolytes and Surfaces; 10.7907/eey8-et93
• Sun, Jiace (2025) Classical and Quantum Simulation of Chemical and Physical Systems; 10.7907/3qp8-q490
• Mukasa, Daniel (2025) Computational Design of Wearable Chemical Sensors for Personalized Healthcare; 10.7907/r46k-sw73
• Nimlos, Danika Katherine (2025) Development and Characterization of a Table-Top Laser-Produced Plasma Source for In-Situ and Time-Resolved Soft X-Ray Absorption Spectroscopy; 10.7907/3e9t-xr72
• Gonzalvo i Ulla, Marta (2025) Computational Methods for Nucleic Acid Structure Prediction and G Protein-Coupled Receptor Mechanism Investigation; 10.7907/bxdy-5x58
• Musgrave, Charles Bruce, III (2025) Computational Approaches to Problems in Energy and Sustainability; 10.7907/hnc1-je90
• Cusumano, Alexander Quinn (2024) Asymmetric Pericyclic Transformations from Reactive Palladium Intermediates; 10.7907/b0wn-wt67
• Cusumano, Alexander Quinn (2024) Asymmetric Pericyclic Transformations from Reactive Palladium Intermediates; 10.7907/b0wn-wt67
• Jones, Gregory Harrison (2024) From Venus to Mars: Spectroscopy and Kinetics of Reactive Intermediates in Planetary Atmospheres; 10.7907/7010-fc76
• Lin, Haw-Wei (2024) Nonlinear and Multidimensional Terahertz Spectroscopy of Liquids and Crystalline Solids; 10.7907/2qt0-mg05
• 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
• Virgil, Kyle Allan (2024) Polarization-Resolved, Oblique Incidence Terahertz Spectroscopy of Highly Uniform 2D Hybrid Perovskite Films; 10.7907/cr97-p373
• Böhme, Annette Ellen (2024) Observation of the Microenvironment Around CO₂ Reduction Electrodes via Fluorescent Confocal Laser-Scanning Microscopy; 10.7907/ceqb-ew84
• 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
• Palfey, William Richard (2024) Hydrogen Incorporation in Rutile- and Perovskite-Structured Minerals and Their Analogues; 10.7907/nbyx-6446
• Grayson, Robert Wall (2024) Low-Energy Plasma–Surface Interactions at Airless Icy Bodies; 10.7907/fn7c-k591
• Korol, Roman (2024) Development and Applications of Imaginary Time Path Integral Methods; 10.7907/jy10-rf87
• Lucas, Éowyn (2023) Advancement of Asymmetric Bipolar Membranes for Tailoring Chemical Environments in Electrochemical Systems; 10.7907/jken-ty64
• Qiao, Zhuoran (2023) Physics-Informed Neural Approaches for Multiscale Molecular Modeling and Design; 10.7907/48d1-ja21
• 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
• Lawniczak, James Joseph (2023) Computational Investigations of Organometallic Catalysis; 10.7907/aepb-jm46
• Saunders, Claire Nicole (2022) Thermal Behavior of Cuprous Oxide: a Comprehensive Study of Three-Body Phonon Effects and Beyond; 10.7907/mate-2v65
• Cheng, Lixue (2022) Accurate and Transferable Molecular-Orbital-Based Machine Learning for Molecular Modeling; 10.7907/cjak-4x38
• 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
• 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
• Gu, Alan Yalun (2022) Aqueous Aerosols in Atmospheric Chemistry and Airborne Diseases; 10.7907/4spy-az88
• Loke, Samuel Pei Hao (2022) Photovoltaic Technologies Developed for Space-Based Solar Power; 10.7907/6jhy-2623
• Kim, Seungkyeum (2022) Development of Electrochemical Processes for More Practical and Effective Onsite Wastewater Treatment; 10.7907/ab1v-he77
• Welch, Alexandra Justine (2022) Understanding and Optimizing the Local Catalyst Environment in CO₂ Reduction Electrodes; 10.7907/4s78-cq55
• Chen, Yalu (2021) Computational Investigation of Nanoscale Electrocatalysts for Clean Energy Conversion; 10.7907/tgw8-c485
• Ford, Rachel Rae (2021) Controlling the Dynamics of Microstructure Formation in Mixed-Matrix Polymeric-Particle Membranes; 10.7907/fqgq-vd04
• Buabthong, Pakpoom (Pai) (2021) Stability and Protective Coatings of Semiconductor Electrodes for Solar Fuel Devices; 10.7907/dx7s-fh20
• Lee, Kyra SoHyun (2021) 2-D Material Sensors on the Electronic Nose for the Sensitive Detection of VOCs; 10.7907/j5e1-k535
• Bagley, Jacob David (2021) Fabrication of Pristine and Doped Graphene Nanostripes and their Application in Energy Storage; 10.7907/hfdw-fs13
• Cheng, Wen-Hui (Sophia) (2020) Towards High Solar to Fuel Efficiency: From Photonic Design, Interface Study, to Device Integration; 10.7907/kd6a-xt88
• Jhalani, Vatsal A. (2019) Light Emission and Ultrafast Carrier Dynamics in III-V Semiconductors from First Principles; 10.7907/9E0D-KX54
• Qian, Jin (2019) From Quantum Mechanics to Experimental Observables: Computational Investigations of Energy-Related Heterogeneous Catalysts; 10.7907/SPEJ-5X35
• Huang, Yufeng (2019) Computational Heterogeneous Electrochemistry – From Quantum Mechanics to Machine Learning; 10.7907/MCGV-Y790
• Yalamanchili, Sisir (2019) Light Management in Photovoltaics and Photoelectrochemical Cells using Tapered Micro and Nano Structures; 10.7907/RRYM-VK03
• Giwa, Adenike Monsurat (2019) Microstructure and Small-Scale Deformation of Al₀.₇CoCrFeNi High-Entropy Alloy; 10.7907/PSWX-RY20
• Paik, Haemin (2019) Development of Electrocatalysts in Solid Acid Fuel Cells; 10.7907/C96K-Z389
• Gethers, Matthew Leroy, III (2018) Therapeutic Opportunities and Approaches to Sequence Control for Nucleic Acids; 10.7907/WE1E-EZ49
• Brooks, Daniel James (2018) Computational Investigation of Ionic Diffusion in Polymer Electrolytes for Lithium-Ion Batteries; 10.7907/ZE9T-V407
• Niesen, Michiel Jacobus Maria (2018) Coarse-Grained Simulation Approaches for Protein Integration and Translocation via the Sec Translocon; 10.7907/Z91N7ZBS
• Liang, JingXin (2018) Interrogating the Structural Landscape of Malaria Biomarkers with Epitope Targeted Peptide Capture Agents; 10.7907/rxtr-6152
• Yang, Kuang-Wei (2018) Synthesis, NMR Solution Structure, and Neuritogenic Activity of Chondroitin Sulfate D and E; 10.7907/TPD7-FB87
• Torelli, Daniel Anthony (2018) The Discovery of Novel Materials for the Electrocatalytic Reduction of Carbon Dioxide; 10.7907/RBD5-B141
• Luo, Shi (2018) Microstructural Effects on Diffusion and Mechanical Properties in Different Material Systems; 10.7907/Z90G3HBV
• Jiang, Jingjing (2018) Interfacial and Stability Studies of Photocathodes for Hydrogen Evolution; 10.7907/SBJ9-D062
• 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
• Miller, Gregory Martin (2018) Eph Receptor Clustering by Chondroitin Sulfate Inhibits Axon Regeneration; 10.7907/Z9RJ4GPT
• Zhou, Xinghao (2018) Performance and Stability Optimization of Solar Fuel Devices; 10.7907/SSNP-XW29
• Plymale, Noah Thomas (2017) Spectroscopic, Electronic, and Mechanistic Studies of Silicon Surfaces Chemically Modified with Short Alkyl Chains; 10.7907/Z9FF3QB1
• 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
• Verlage, Erik A. (2017) High-Efficiency Solar Fuel Devices: Protection and Light Management Utilizing TiO2; 10.7907/Z9MC8X2P
• 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
• Murialdo, Maxwell Robert (2017) Anomalous Thermodynamics of Nonideal Gas Physisorption on Nanostructured Carbons; 10.7907/Z9GH9FXM
• Roske, Christopher William (2017) Towards a Hydrobromic Acid Splitting Device Using Earth-Abundant Materials; 10.7907/Z9NS0RWS
• Saadi, Fadl Hussein (2017) Acid-Stable Electrocatalysts for the Solar Production of Fuels; 10.7907/Z9QF8QV4
• Kim, Hyun-Sik (2016) Thermoelectric Properties of Bismuth Antimony Telluride Alloys; 10.7907/Z9RN35V0
• Shing, Amanda M. (2016) Development of Zn-IV-Nitride Semiconductor Materials and Devices; 10.7907/Z94Q7RXJ
• Crowley, Jason Michael (2016) Resolution of the Band Gap Prediction Problem for Materials Design; 10.7907/Z9D21VKZ
• Liu, Fan (2016) Classical Force Field Simulations of Biological Processes and Quantum Chemical Computations of Homogeneous Catalysts; 10.7907/Z94M92J2
• Tang, Yinglu (2016) Thermoelectric Skutterudites: Why and How High zT Can Be Achieved; 10.7907/Z9TD9VB1
• 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
• 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
• Hong, Qi-Jun (2015) Methods for Melting Temperature Calculation; 10.7907/Z98C9T6H
• Cvicek, Vaclav (2015) Structure Prediction of G-Protein Coupled Receptors; 10.7907/Z9S46PVG
• Kameel, Fathima Rifkha (2015) Oxidation of Volatile Organic Compounds in Aqueous Solution and at the Air-water Interface of Aqueous Microdroplets; 10.7907/Z9MP5174
• Aitken, Zachary Howard (2015) Effect of Microstructural Interfaces on the Mechanical Response of Crystalline Metallic Materials; 10.7907/Z9C24TCP
• Barnes, Taylor Arnold (2015) Development and Application of Embedding Methods for the Simulation of Large Chemical Systems; 10.7907/Z9KK98P1
• Kirkpatrick, Andrea (2015) Computational Predictions of G Protein-Coupled Receptor Structures and Binding Sites; 10.7907/Z9NG4NJG
• Narang, Prineha (2015) Light-Matter Interactions in Semiconductors and Metals: From Nitride Optoelectronics to Quantum Plasmonics; 10.7907/Z9513W4S
• Xiao, Hai (2015) First Principles Based Multiparadigm Modeling of Electronic Structures and Dynamics; 10.7907/Z94747T1
• 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
• Tsai, Ho-Cheng (2015) Quantum Mechanics Studies of Fuel Cell Catalysts and Proton Conducting Ceramics with Validation by Experiment; 10.7907/Z9P55KFW
• Ji, Chenguang (2015) Design of Antenna-Coupled Lumped-Element Titanium Nitride KIDs for LongWavelength Multi-Band Continuum Imaging; 10.7907/Z9W66HQ7
• 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
• Aryanfar, Asghar (2015) Dendrites Inhibition in Rechargeable Lithium Metal Batteries; 10.7907/Z9ZK5DMP
• Jeon, Seokmin (2014) Structure, Chemistry, and Energetics of Organic and Inorganic Adsorbates on Ga-rich GaAs and GaP(00l) Surfaces; 10.7907/1T2B-J793
• 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, Xiao (2014) A Study on Iron-Based Amorphous Alloys: Alloy Development, Thermodynamics and Soft Magnetism; 10.7907/X2WM-RA54
• Lan, Tian (2014) Studies of Phonon Anharmonicity in Solids; 10.7907/AB7A-FP25
• 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
• Liu, Wei-Guang (2014) First-Principle Studies of the Initiation Mechanism of Energetic Materials; 10.7907/Z9445JGM
• 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
• 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
• Chitsaz, Mohsen (2014) Protein Structure Refinement Algorithms; 10.7907/7731-QM74
• Garrett, Glenn Robert (2013) Study of the Origins of Toughness in Amorphous Metals; 10.7907/Z9JD4TRM
• Muñoz, Jorge Alberto (2013) Electronic Structure and Phonon Thermodynamics of Iron Alloys; 10.7907/7EJD-RP70
• Jang, Min Seok (2013) Plasmonics and Electron Optics in Graphene; 10.7907/59RB-9653
• Stadie, Nicholas P. (2013) Synthesis and Thermodynamic Studies of Physisorptive Energy Storage Materials; 10.7907/ZK3P-CV60
• Varga, Aron (2013) Advancing Electrocatalysis in Solid Acid Fuel Cells; 10.7907/Z9RX992C
• 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
• Pomrehn, Gregory Schoelerman (2013) Phase Stability and Defect Behavior in Complex Thermoelectric Zinc-Antimonides; 10.7907/0AWH-4P69
• Hwang, Kiwook (2013) Biotechnologies for Cancer Diagnostics: Cell Sorting, Protein Analysis and Imaging of Cellular Metabolism; 10.7907/Z6DN-0483
• Mishra, Himanshu (2013) Proton Transfers at the Air-Water Interface; 10.7907/A9HR-PN89
• Kurji, Zuleikha (2013) Molecular Design of Side-Group Liquid Crystalline Polymers: Understanding Their Interactions with Small Molecule Liquid Crystal Solvent; 10.7907/Z9WH2N6R
• Li, Chen W. (2012) Phonon Anharmonicity of Ionic Compounds and Metals; 10.7907/7VS5-0F52
• Tiwary, Pratyush (2012) Atomistic Simulations of Materials: Methods for Accurate Potentials and Realistic Time-Scales; 10.7907/J8W9-XS70
• Yu, Ted H. (2012) Degradations and Improvements in PEM Fuel Cell Materials: A Computational Study ; 10.7907/0CYM-2B74
• Yu, Jen-Kan (2012) Nanostructured Silicon Thermoelectrics; 10.7907/HPEF-BM21
• 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
• 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
• Cheng, Mu-Jeng (2012) Mechanistic Insights into Alkane C-H Activation and Functionalization by Metal Oxide Surfaces and Organometallic Complexes; 10.7907/K4XH-V434
• An, Qi (2012) Atomistic Simulations of Material Properties under Extreme Conditions; 10.7907/E3Z0-1A27
• Theofanis, Patrick Lauren (2012) The Quantum Electron Dynamics of Materials Subjected to Extreme Environments; 10.7907/BJ5N-QV45
• Tadross, Pamela Michele (2012) Exploiting the Reactivity of Arynes in the Total Synthesis of Natural Products; 10.7907/0HAZ-QF41
• 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
• Han, Si-ping (2011) DNA Directed Self-Assembly of Carbon Nanotube Structures; 10.7907/3ZN9-T618
• Walker, Don (2011) Corrole Sensitized Solar Cells; 10.7907/XQBW-D585
• Brown, Evan Cornell (2011) Electrochemically Deposited Ceria Structures for Advanced Solid Oxide Fuel Cells; 10.7907/93NE-TG09
• Cable, Morgan Leigh (2010) Life in Extreme Environments: Lanthanide-Based Detection of Bacterial Spores and Other Sensor Design Pursuits; 10.7907/0NFE-Y329
• Anderson, Amos Gerald (2010) Quantum Monte Carlo: Faster, More Reliable, and More Accurate; 10.7907/KVTV-N754
• Bray, Jenelle Kiara (2010) The Development and Application of Computational Methods for the Prediction of G Protein-Coupled Receptor Structures; 10.7907/1655-ES74
• Fisher, Daniel Ross (2010) Development and Applications of Quantum Monte Carlo; 10.7907/4YCS-9T88
• 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
• Liu, Yu (2010) Biochemical Reactions in Confined Space; 10.7907/W9H8-8T44
• Mueller, Jonathan Edward (2010) Structures, Energetics and Reactions of Hydrocarbons on Nickel; 10.7907/RVXX-Z341
• Kim, Hyungjun (2009) Multiscale and Multiphysics Computational Frameworks for Nano- and Bio-Systems; 10.7907/0PFF-R531
• Sheriff, Bonnie Ann (2009) Silicon Nanowires and Silicon/Molecular Interfaces for Nanoscale Electronics; 10.7907/Q13E-NB40
• Wiencko, Heather L. (2009) Adrenergic Receptors: Model Systems for Investigation of GPCR Structure and Function; 10.7907/S3RC-RZ59
• 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
• 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
• Torrice, Michael McCann (2009) Chemical-Scale Studies of the Nicotinic and Muscarinic Acetylcholine Receptors; 10.7907/4WKT-NB09
• Kekenes-Huskey, Peter Michael (2009) A Monte Carlo-Based Torsion Construction Algorithm for Ligand Design; 10.7907/A1MQ-3116
• Hanek, Ariele Patrice (2009) Chemical-Scale Investigations of Cys-Loop Neurotransmitter Gated Ion Channels; 10.7907/FSYX-Y861
• Matsuda, Yuki (2009) Ab Initio Quantum Mechanical Studies in Electronic and Structural Properties of Carbon Nanotubes and Silicon Nanowires; 10.7907/7FXD-ZQ68
• 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, John Andrew (2008) Computational Insight into Homogeneous Organopalladium Catalysis; 10.7907/FAS9-DV26
• 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
• Duan, Gang (2008) Simulations, Modeling, and Designs of Bulk Metallic Glasses; 10.7907/ZH3G-JF43
• Caspi, Daniel David (2008) The Adaptive Nature of Palladium Reactivity in Synthesis; 10.7907/N37A-5970
• 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
• Kam, Victor Wai Tak (2008) Methods in Computational Protein Design; 10.7907/S7KW-0M44
• Jordan, Jason Paul (2008) The Development of Water-Soluble Olefin Metathesis Catalysts Containing an N-Heterocyclic Carbene Ligand; 10.7907/B57A-ZS49
• McFadden, Ryan Michael (2008) Applications of Palladium-Catalyzed Enantioselective Decarboxylative Alkylation in Natural Products Total Synthesis; 10.7907/GQ1E-RW28
• 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
• Green, Jonathan Earl (2007) Ultra-Dense Nano- and Molecular-Electronic Circuits; 10.7907/HCQH-2S48
• Liu, Jian (2007) Microfluidic Devices for Genetic Analysis and Gene Expression Studies; 10.7907/xnm0-4a75
• Behenna, Douglas Carl (2007) Progress Toward the Synthesis of (+)-Zoanthenol and the Development of an Asymmetric Tsuji Allylation Reaction; 10.7907/46KF-QE46
• 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
• Dodd, Joanna Lynn (2007) Phase Composition and Dynamical Studies of Lithium Iron Phosphate; 10.7907/0B7N-ZF63
• Harmon, John Shelby, III (2007) Experimental Studies of Elasticity, Plastic Flow, and Anelasticity in Metallic-Glass-Forming-Liquids; 10.7907/53AD-3G15
• Heo, Jiyoung (2007) Computational Studies of Orphan G Protein-Coupled Receptors; 10.7907/rmmr-sj52
• 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
• Nielsen, Robert J. (2005) Computational Strategy in Catalyst Design; 10.7907/60VH-AQ40
• Peng, Joyce Yaochun (2005) Structure and Function Prediction of Human Muscarinic Acetylcholine Receptor 1, Cation-π Studies, and Protein Design; 10.7907/XVJR-RN32
• Peng, Joyce Yaochun (2005) Structure and Function Prediction of Human Muscarinic Acetylcholine Receptor 1, Cation-π Studies, and Protein Design; 10.7907/XVJR-RN32
• Wu, Jian (2005) Defect Chemistry and Proton Conductivity in Ba-based Perovskites; 10.7907/VTCG-T978
• Dirks, Robert Michael (2005) Analysis, Design, and Construction of Nucleic Acid Devices; 10.7907/VZ43-FM66
• Hall, Spencer Eugene (2005) Development of a Structure Prediction Method for G-Protein Coupled Receptors; 10.7907/JN28-5F55
• Sharma, Shantanu (2005) Prediction of Structure and Antagonist Binding Site in Human and Rodent Chemokine Receptor 1; 10.7907/j4zd-ny21
• Benitez, Diego (2005) Theoretical Study of the Mechanism of Olefin Metathesis and Synthesis of Cyclic Polymers; 10.7907/eas9-x408
• 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
• 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
• Sisk, Brian Christopher (2005) Computational Optimization of Chemical Vapor Detector Arrays; 10.7907/Z3K5-C749
• Rutenberg, Isaac Michael (2005) Functionalized Polymers and Surfaces via Ring-Opening Metathesis Polymerization; 10.7907/5Z6Y-G191
• Zhang, Qingsong (2005) Atomistic Simulation of Barium Titanate; 10.7907/SQ9J-4H73
• Li, Youyong (2005) Atomistic Simulation of Macromolecules; 10.7907/NW1Q-1E81
• Mukherjee, Sundeep (2005) Study of Crystallization Behavior, Kinetics and Thermodynamics of Bulk Metallic Glasses Using Noncontact Electrostatic Levitation Technique; 10.7907/33FY-8482
• Staneff, Geoffrey D. (2005) High-Pressure Synthesis of Thermoelectric Materials; 10.7907/HWWN-NS80
• Boysen, Dane Andrew (2004) Superprotonic Solid Acids: Structure, Properties, and Applications; 10.7907/41BQ-3R07
• Trabanino, Rene Jouvanni (2004) Prediction of Structure, Function, and Spectroscopic Properties of G-Protein-Coupled Receptors: Methods and Applications; 10.7907/VHED-4063
• Elmore, Donald Eugene, Jr. (2004) Investigations of Ion Channel Structure-Function Relationships Using Molecular Modeling and Experimental Biochemistry; 10.7907/47GW-HT46
• Gstrein, Florian (2004) Electron-Transfer Processes at Semiconductor/Liquid Interfaces and Metal/Nanogap Junctions; 10.7907/1NT2-FB12
• Deng, Wei-Qiao (2004) Computation Aided Design in Molecular Nanotechnology; 10.7907/3EKY-3J53
• Kalani, M. Yashar S. (2004) Structure and Function Studies of the Human Dopamine Receptors; 10.7907/T6NV-7W30
• 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
• Scherman, Oren Alexander (2004) Enhancing Materials Through Controlled Architectures with Ring-Opening Metathesis Polymerization; 10.7907/E1BS-HG72
• Mayo, Elizabeth Idonia (2004) Kinetics and Thermodynamics of Dye (Group VIII Metal)–Sensitized Nanocrystalline Titanium Dioxide Photoelectrodes; 10.7907/E9WY-1N05
• Wang, Pin (2004) Expanding the Biosynthetic Capacity of the Aminoacyl-tRNA Synthetases; 10.7907/99W6-8F08
• Kent, David Randall, IV (2003) New Quantum Monte Carlo Algorithms to Efficiently Utilize Massively Parallel Computers; 10.7907/V64A-V618
• Lee, Hyon-Jee (2003) Molecular Dynamics Studies of Metallic Glasses; 10.7907/ZE5V-VZ33
• 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
• 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
• Datta, Deepshikha (2003) Protein-Ligand Interactions: Docking, Design and Conformation Change; 10.7907/36FS-2262
• 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
• 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
• Sobrero, Aquiles Carlos (2002) Surface Structure Determination by Low-Energy Electron Diffraction; 10.7907/9b54-km20
• Amashukeli, Xenia (2002) Electron-Transfer Reorganization Energies of Isolated Molecules
• Wang, Guofeng (2002) First Principles Based Multiscale Modeling of Single Crystal Plasticity: Application to BCC Tantalum; 10.7907/5nyn-ct36
• Zamanakos, Georgios (2002) A Fast and Accurate Analytical Method for the Computation of Solvent Effects in Molecular Simulations; 10.7907/B7W8-N760
• Sobrero, Aquiles Carlos (2002) Surface Structure Determination by Low-Energy Electron Diffraction; 10.7907/9b54-km20
• 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
• Bogdanoff, Peter David (2002) The Phonon Entropy of Metals and Alloys: The Effects of Thermal and Chemical Disorder; 10.7907/045G-6426
• Bolon, Daniel N. (2002) Computational Enzyme Design; 10.7907/W7F3-DS14
• Kua, Jeremy Soo Pin (2001) Computational Studies of Heterogeneous and Homogeneous Catalysis by Late Transition Metals; 10.7907/M9WN-7M53
• Szczepankiewicz, Steven Henry (2001) Surface Chemistry of TiO₂ Photocatalysts; 10.7907/HABJ-3T48
• Szczepankiewicz, Steven Henry (2001) Surface Chemistry of TiO₂ Photocatalysts; 10.7907/HABJ-3T48
• 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
• Manley, Michael Edward (2001) From Elementary Excitations to Microstructures: the Thermodynamics of Metals and Alloys Across Length Scales; 10.7907/WECC-4662
• Chang, Aileen Yulin (2001) Cleavage of DNA by Polamide-Seco-CB1 Conjugates; 10.7907/FY0F-DW57
• Brandow, Christopher Graham (2001) Zirconocenes as Models for Homogeneous Ziegler-Natta Olefin Polymerization Catalysts; 10.7907/kxb2-wp19
• Kirkland, Thomas Andrew (2000) Expanding the Applications of Transition Metal Alkylidenes and Alkylidynes to Organic Synthesis; 10.7907/w770-7r65
• 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
• Carlson, Matt Jeffrey (2000) BUFF: A Biological Universal Forcefield Derived from Quantum Mechanics; 10.7907/5kyh-4402
• 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
• Gordon, David Benjamin (2000) Combinatorial Optimization in Computational Protein Design; 10.7907/fzxm-d394
• Lu, Daqi (2000) Theoretical Studies of the Nonlinear Optical Properties of Organic Materials; 10.7907/myx9-7278
• Scholl, Matthias (2000) Expanding the Scope of Ruthenium-Based Olefin Metathesis Catalysts; 10.7907/55x3-h359
• Gordon, David Benjamin (2000) Combinatorial Optimization in Computational Protein Design; 10.7907/fzxm-d394
• 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
• Unger, Marc Alexander (1999) Advances in High-Resolution Probes for Scanning Probe Microscopy; 10.7907/xqdw-8009
• Martin, Jeremy Isaac (1998) Statistical Mechanics of End-Attached Polymer Interfaces; 10.7907/4pc9-vz14
• Gao, Guanghua (1998) Large Scale Molecular Simulations with Application to Polymers and Nano-Scale Materials; 10.7907/69rm-7y79
• Martin, Jeremy Isaac (1998) Statistical Mechanics of End-Attached Polymer Interfaces; 10.7907/4pc9-vz14
• Iotov, Mihail S. (1998) Diffusion in Amorphous Media; 10.7907/9b0m-2j57
• Dahiyat, Bassil I. (1998) Protein Design Automation : Principles and Practice; 10.7907/08j5-w532
• 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
• Zuercher, William John (1998) Ruthenium-Catalyzed Polycyclization Reactions; 10.7907/2857-9b48
• Ramirez, Benjamin E. (1998) The CUₐ center of cytochrome oxidase : electronic structure calculations and electron-tunneling pathways; 10.7907/r7t8-xt78
• Hastings, Curtis Asa (1998) Part A. Studies Directed Toward the Total Synthesis of Chebulagic Acid. Part B. DNA Recognition by Metallointercalator-Peptide Conjugates; 10.7907/e4be-bd57
• Lim, Ai Ching (1998) Investigation of RNA Tertiary Structure and Function by Transition Metal Complexes
• Belmares, Michael Paul (1998) Molecular Origins of the Thermophysical Properties of Polymers and Modeling of Polymer Permeation by Large Molecules; 10.7907/vnw1-8367
• Tsai, Bao-Liang (1997) First principles studies of semiconductor epitaxial growth; 10.7907/2CV3-2A62
• Mines, Gary Alan (1997) Cytochrome c : Folding Triggered by Electron Transfer. Rates of Heme Oxidation and Reduction at High Driving Forces; 10.7907/rtx8-jn96
• Melnik, M. Susan (1997) Diamond surfaces : interactions with hydrogen and halogens; 10.7907/gdrt-7n92
• McPhillips, Timothy M. (1997) X-ray Crystallographic Studies of the R65Q Mutant of Yeast Phosphoglycerate Kinase; 10.7907/p1pg-0748
• Jonscher, Karen Rae (1997) Quadrupole Ion Trap Mass Spectrometry of Peptides; 10.7907/9btc-bk47
• 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
• Gerdy, James Joseph (1996) Accurate Interatomic Potentials for Simulations; 10.7907/g2gs-kv14
• Claverie, Jérôme (1996) Ring-Opening Metathesis Polymerization with Tungsten Based Catalysts: Kinetics, Thermodynamics and Mechanism; 10.7907/h6fj-1t43
• Colocci, Natalia (1996) Cooperative Oligonucleotide-Directed Triple Helix Formation at Adjacent DNA Sites; 10.7907/08j6-sd37
• Heikal, Ahmed Abdou (1996) Ultrafast molecular dynamics in complexed trans-stilbene; 10.7907/p3gz-kj57
• Johnson, Matthew Stanley (1996) Spectroscopy of Reactive Molecules and Clusters; 10.7907/ta23-4185
• 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
• 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
• Hua, Xinlei (1996) First principles simulations : development of new density functionals and pseudopotentials and formation mechanism of fullerenes; 10.7907/r7qa-wt76
• Wang, Neng E. (1995) Studies in dynamics; 10.7907/j1ch-3v41
• Bierwagen, Erik Paul (1995) Computational Studies of Ziegler-Natta Catalysis and Concurrent Resonance Computations; 10.7907/3w1m-hk72
• 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
• Bierwagen, Erik Paul (1995) Computational Studies of Ziegler-Natta Catalysis and Concurrent Resonance Computations; 10.7907/3w1m-hk72
• Lim, Kian-Tat (1995) Mega-molecular dynamics on highly parallel computers : methods and applications; 10.7907/e3qc-t131
• Langlois, Jean-Marc (1994) New methods for ab initio quantum mechanical calculations in molecular and crystalline systems; 10.7907/j75s-5f43
• Li, Mo (1994) Crystal to Glass Transition and its Relation to Melting; 10.7907/a2hw-gm49
• Evans, John Spencer (1993) NMR and Computational Studies on the Conformational Folding of the Biomineralization Template, Posphophoryn; 10.7907/ky1z-w552
• 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
• Baselt, David Randall (1993) The Tip-Sample Interaction in Atomic Force Microscopy and its Implications for Biological Applications; 10.7907/5ZMM-7Q64
• Tahir-Kheli, Jamil (1992) The infinite range Heisenberg model and high temperature superconductivity; 10.7907/9JDD-4P11
• 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
• Chen, Guanhua (1992) Superconductivities of high-T_c materials and alkali compounds of Buckminsterfullerene; 10.7907/chz3-cq25
• Karasawa, Naoki (1992) Simulations of polymer crystals : new methods and applications; 10.7907/mjj7-qt65
• 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
• Donnelly, Robert Edward (1992) Modeling and visualizing surfaces; 10.7907/1d15-vv30
• Baker, Shenda Mary (1992) Scanning Tunneling Microscopy and Spectroscopy of Silicon and Carbon Surfaces; 10.7907/5JGQ-4X60
• 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
• Nikzad, Shouleh (1990) A Study of Ion Beam Sputtering of Compound Materials with Laser Spectroscopy; 10.7907/kgvz-n067
• Nikzad, Shouleh (1990) A Study of Ion Beam Sputtering of Compound Materials with Laser Spectroscopy; 10.7907/kgvz-n067
• 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
• Shin, Seung Koo (1989) Experimental and Theoretical Studies of Silylenes, Silicenium Ions, and Organometallic Reactive Intermediates; 10.7907/sdj1-2y57
• Shin, Seung Koo (1989) Experimental and Theoretical Studies of Silylenes, Silicenium Ions, and Organometallic Reactive Intermediates; 10.7907/sdj1-2y57
• Smith, David Charles (1989) Electronic Structure and Photochemical Reactivity of Binuclear Metal Complexes; 10.7907/q1gz-dn84
• Pranata, Julianto (1989) Theoretical Studies of Novel Organic Systems: Biradicals, Polyradicals, and Conducting Polymers; 10.7907/x0ka-7s95
• Lo, Davy (1989) Molecular Dynamics Simulation of Sputtering; 10.7907/EVKV-AW57
• Lo, Davy (1989) Molecular Dynamics Simulation of Sputtering; 10.7907/EVKV-AW57
• 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
• 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
• 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
• Klippenstein, Stephen Jacob (1988) Theoretical Studies of Chemical Reaction Dynamics; 10.7907/dbrd-wj15
• 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
• Anslyn, Eric Van (1988) Mechanistic, Synthetic and Theoretical Studies of High Valent Metallacycles and metal Alkylidenes; 10.7907/m7kp-4g32
• McAdon, Mark Herbert (1988) New Concepts of Metallic Bonding; 10.7907/jtpr-6m88
• Swager, Timothy Manning (1988) Precursor Routes to Conducting Polymers from the Ring-Opening Metathesis Polymerization of Cyclic Olefins; 10.7907/KF6P-FC76
• Petti, Michael Anthony (1988) Studies in Molecular Recognition; 10.7907/wvhj-nb98
• 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
• Mayo, Stephen Leon (1988) Electron Transfer in Structurally Engineered Metalloproteins; 10.7907/YJKW-3133
• Cheng, Yang-Tse (1987) Ion-Beam Mixing and the Formation of Amorphous Alloys; 10.7907/W1Y4-0347
• Schilling, Jerald Bruce (1987) Experimental and Theoretical Aspects of Hydrocarbon Activation by Transition Metal Ions in the Gas Phase; 10.7907/vazp-zt83
• Holden, Peter James (1987) Extension Theorems for Functions of Vanishing Mean Oscillation; 10.7907/f7k9-rh88
• Carter, Emily Ann (1987) Finesse in Quantum Chemistry: Accurate Energetics Relevant for Reaction Mechanisms; 10.7907/GVJQ-6Y71
• Jain, Rakesh (1987) Direct Observation and Reactions of Organic Biradicals Generated from Novel Bicyclic Azoalkanes; 10.7907/z16r-7e62
• Tsai, Wilman (1987) Interactions of Ammonia with Platinum and Ruthenium Surfaces; 10.7907/4Y3N-2321
• Vajo, John J. (1987) Mechanistic Studies of Heterogeneously Catalyzed Reactions of Ammonia and Acetic Acid on Platinum Surfaces; 10.7907/vayx-4k53
• Onuchic, José Nelson (1987) New aspects of the theory of electron transfer reaction dynamics; 10.7907/hcep-rh59
• Meinhart, James Douglas (1987) Synthesis and Reactivity of Titanocene Methylene Complexes and Bis(η⁵-Cyclopentadienyl) Titanacyclobutenes; 10.7907/16dt-2465
• Sponsler, Michael Bradley (1987) Synthesis, EPR Spectroscopy, and Matrix-Isolation Decay Kinetics of Triplet Cyclobutanediyls; 10.7907/me26-sd58
• Sponsler, Michael Bradley (1987) Synthesis, EPR Spectroscopy, and Matrix-Isolation Decay Kinetics of Triplet Cyclobutanediyls; 10.7907/me26-sd58
• Cheng, Yang-Tse (1987) Ion-Beam Mixing and the Formation of Amorphous Alloys; 10.7907/W1Y4-0347
• 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
• 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
• 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
• 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
• Tolbert, Margaret A. (1986) Mechanisms and Energetics of Alkane Activation by Transition Metal Ions in the Gas Phase; 10.7907/3047-z490
• Tolbert, Margaret A. (1986) Mechanisms and Energetics of Alkane Activation by Transition Metal Ions in the Gas Phase; 10.7907/3047-z490
• 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
• 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
• Hood, Diane Marie (1986) Calculation of e⁻-H Atom Scattering Processes Using Hyperspherical Coordinates; 10.7907/xj5h-me61
• Hood, Diane Marie (1986) Calculation of e⁻-H Atom Scattering Processes Using Hyperspherical Coordinates; 10.7907/xj5h-me61
• Atzmon, Michael (1986) A Study of Bulk Amorphous Alloys Formed by Solid-State Reaction in Elemental Composites; 10.7907/5M6N-SK53
• 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
• Low, John James (1985) Theoretical Studies of Oxidative Addition and Reductive Elimination; 10.7907/XR1N-CM33
• Flanagan, Dorothy Jean (1985) The Angular Resolved Photoelectron Spectroscopy of Various Polyatomic Molecular Systems; 10.7907/f9mq-vz30
• Collins, Reuben Theodore (1985) Electronic Properties of Heterostructures and Defects in Compound Semiconductors; 10.7907/pg8h-k549
• Collins, Reuben Theodore (1985) Electronic Properties of Heterostructures and Defects in Compound Semiconductors; 10.7907/pg8h-k549
• Szuromi, Phillip David (1985) Studies of Hydrocarbon Reactions on Low-Index Iridium and Platinum Surfaces; 10.7907/ndxy-rb82
• Allison, Janet Noel (1985) Theoretical Studies of Heterogeneous Catalysis of Molybdates; 10.7907/wpmx-ff05
• 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
• 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
• Dolgin, Benjamin Paul (1985) Kinetics of the Formation of an Amorphous Layer During a Solid State Reaction; 10.7907/n0qt-h472
• 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
• Garvey, James F. (1985) The Production and Characterization of an Intense Hyperthermal Beam of H₃ Molecules and of H Atoms; 10.7907/r4n1-8762
• 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
• Hanratty, Maureen Alice (1985) Investigations of the Mechanisms and Energetics for Transition Metal Ion Mediated Reactions; 10.7907/6mqm-3w23
• Winniczek, Jaroslaw W. (1985) Anisotropic Interaction Potentials between Helium and Linear Molecules from Crossed Beam Experiments; 10.7907/5nvw-ym37
• 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
• 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
• Baxter, David Verge (1984) EXAFS Studies of La-Ga Metallic Glasses; 10.7907/NHED-5T47
• Goodgame, Marvin Mark (1984) Exchange Forces in Transition-Metal Bonding; 10.7907/xs72-nm31
• Mailhiot, Christian (1984) Theoretical Investigations of Electron States in Small-Scale Semiconductor Structures; 10.7907/0470-nf89
• Winkler, Jay Richmond (1984) Spectroscopy and Photochemistry of Metal-Oxo Complexes; 10.7907/DE5E-2Y69
• Gurer, Cigdem (1984) Time Dependent and Equilibrium Stress-Strain Behavior of Rubbers in Moderately Large Deformations; 10.7907/e0xe-8w83
• Fitzsimmons, Brian Joseph (1984) The Total Synthesis of the Enantiomer of Lasalocid A; 10.7907/w5gn-5650
• Fitzsimmons, Brian Joseph (1984) The Total Synthesis of the Enantiomer of Lasalocid A; 10.7907/w5gn-5650
• Gurer, Cigdem (1984) Time Dependent and Equilibrium Stress-Strain Behavior of Rubbers in Moderately Large Deformations; 10.7907/e0xe-8w83
• Steigerwald, Michael Louis (1984) 2ₛ + 2ₛ Reactions at Transition Metals; 10.7907/S0HZ-TF05
• 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
• 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
• 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
• McIntyre, Daniel Keith (1983) Synthesis and Characterization of 1,1-Di-Tert-Butyldiazene; 10.7907/y54d-s069
• 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
• 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
• Mitch, Charles Howard (1982) The Application of Metallated Enamines to the Synthesis of Morphine Alkaloids; 10.7907/vf0x-tn08
• Millar, David Philip (1982) Picosecond Studies of Molecular Energy Transfer, Reorientation, and Internal Motion Dynamics; 10.7907/NSA9-8028
• Millar, David Philip (1982) Picosecond Studies of Molecular Energy Transfer, Reorientation, and Internal Motion Dynamics; 10.7907/NSA9-8028
• Rianda, Ronald (1982) Electronic Transitions of Molecules by Electron Impact and Multiphoton Ionization Spectroscopy; 10.7907/b7ed-jg16
• 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
• Maverick, Andrew William (1982) Spectroscopy and Photochemistry of Polynuclear Metal Complexes; 10.7907/PBEA-8W62
• 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
• Rianda, Ronald (1982) Electronic Transitions of Molecules by Electron Impact and Multiphoton Ionization Spectroscopy; 10.7907/b7ed-jg16
• Wight, Charles Albert (1982) Chemical Applications of Infrared Laser Photochemistry; 10.7907/gskp-8c88
• Mitch, Charles Howard (1982) The Application of Metallated Enamines to the Synthesis of Morphine Alkaloids; 10.7907/vf0x-tn08
• 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
• 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
• Thiel, Patricia Ann (1981) Adsorption, Co-Adsorption and Catalytic Reactions on Rh(111) and Ru(001) Surfaces; 10.7907/8m9w-p414
• 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. AAu Barriers on InₓGa₁₋ₓP; 10.7907/8hcw-7421
• 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. AAu 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
• 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
• 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