Miller, Thomas F.

Committee Member — 78 thesises

• Cheng, Lixue — Accurate and Transferable Molecular-Orbital-Based Machine Learning for Molecular Modeling (2022, Dissertation (Ph.D.))
• Hui, Aileen Oyama Ah Yee — Atmospheric Peroxy Radical Chemistry Studied by Infrared Kinetic Spectroscopy (2019, Dissertation (Ph.D.))
• Chen, David Zhaoyue — Atomic-Level Structure and Deformation in Metallic Glasses (2016, Dissertation (Ph.D.))
• Tao, Xuecheng — Capturing Nuclear Quantum Effects at Classical Efficiency: a Path-Integral Approach (2022, Dissertation (Ph.D.))
• Ford, Nicole Danielle Bouley — Capturing Protein Dynamics with Time-Resolved Luminescence Spectroscopy (2013, Dissertation (Ph.D.))
• Ho, Samuel Hin-Yuen — Chemical Tools for Protein Imaging in Live Bacterial Cells (2019, Dissertation (Ph.D.))
• Mead, Griffin John — Chirped Pulse Microwave and Single-Shot Terahertz Spectroscopy Studies of Intermolecular Interactions (2021, Dissertation (Ph.D.))
• Niesen, Michiel Jacobus Maria — Coarse-Grained Simulation Approaches for Protein Integration and Translocation via the Sec Translocon (2018, Dissertation (Ph.D.))
• Lee, Sebastian James Rice — Combining High- and Low-Level Electronic Structure Theories for the Efficient Exploration of Potential Energy Surfaces (2021, Dissertation (Ph.D.))
• Sosa Padilla Araujo, Bernardo — Computational Enzyme Design (2014, Dissertation (Ph.D.))
• Huang, Yufeng — Computational Heterogeneous Electrochemistry – From Quantum Mechanics to Machine Learning (2019, Dissertation (Ph.D.))
• Lawniczak, James Joseph — Computational Investigations of Organometallic Catalysis (2023, Dissertation (Ph.D.))
• Fornace, Mark Evan — Computational Methods for Simulating and Parameterizing Nucleic Acid Secondary Structure Thermodynamics and Kinetics (2022, Dissertation (Ph.D.))
• Kirkpatrick, Andrea — Computational Predictions of G Protein-Coupled Receptor Structures and Binding Sites (2015, Dissertation (Ph.D.))
• Jacobson, Daniel Rance — Computational Studies of Dendritic Deposition and Trajectory Phase Coexistence (2022, Dissertation (Ph.D.))
• Shen, Kevin — Conformations and Charge Fluctuations in Polyelectrolyte Solutions (2019, Dissertation (Ph.D.))
• Zimmer, Matthew Holden — Cotranslational Pulling Forces Alter Outcomes of Protein Synthesis (2022, Dissertation (Ph.D.))
• Dulaney, Austin Ryan — Density Fluctuations and Machine Learning in Active Matter (2021, Dissertation (Ph.D.))
• Goodpaster, Jason Daniel — Density Functional Theory Embedding for Correlated Wavefunctions (2014, Dissertation (Ph.D.))
• Wolfe, Brian Robert — Design and Analysis of Nucleic Acid Reaction Pathways (2014, Dissertation (Ph.D.))
• Barnes, Taylor Arnold — Development and Application of Embedding Methods for the Simulation of Large Chemical Systems (2015, Dissertation (Ph.D.))
• Korol, Roman — Development and Applications of Imaginary Time Path Integral Methods (2024, Dissertation (Ph.D.))
• Zhuang, Bilin — Dipolar Liquids and Their Mixtures: Equilibrium and Nonequilibrium Properties with Field-Theoretic Approaches (2017, Dissertation (Ph.D.))
• Kretchmer, Joshua S. — Direct Simulation of Proton-Coupled Electron Transfer Reaction Dynamics and Mechanisms (2015, Dissertation (Ph.D.))
• Menzeleev, Artur R. — Direct Simulation of Quantum Dynamics in Complex Systems (2014, Dissertation (Ph.D.))
• Hwang-Fu, Yu-Hsien — Dynamic Regulations of Co-Translational Protein Targeting by the Signal Recognition Particle Receptor in E. coli and Human (2019, Dissertation (Ph.D.))
• McKone, James Robert — Earth-Abundant Materials for Solar Hydrogen Generation (2013, Dissertation (Ph.D.))
• Wang, Rui — Effects of Self Energy of the Ions on the Double Layer Structure and Properties at the Dielectric Interface (2015, Dissertation (Ph.D.))
• Hamdouche, Samy — Engineered Antibody and Monobody Domains with T Cell Receptor-Like Selectivity for Tumor Associated Peptide-MHC Antigens (2014, Dissertation (Ph.D.))
• Farwell, Christopher C. — Engineering and Characterization of Cytochrome P450 Enzymes for Nitrogen-Atom Transfer Reactions (2015, Dissertation (Ph.D.))
• Trudeau, Devin Lee — Engineering Enzyme Systems by Recombination (2014, Dissertation (Ph.D.))
• Sun, Chong — Finite Temperature Simulations of Strongly Correlated Systems (2021, Dissertation (Ph.D.))
• Liu, Wei-Guang — First-Principle Studies of the Initiation Mechanism of Energetic Materials (2014, Dissertation (Ph.D.))
• Long, David Alexander — Frequency-Stabilized Cavity Ring-Down Spectroscopy of O₂ and CO₂ to Support Atmospheric Remote Sensing (2012, Dissertation (Ph.D.))
• Lunny, Elizabeth Margaret — High-Resolution Photoacoustic Spectroscopy of the Oxygen A-Band (2020, Dissertation (Ph.D.))
• Dempsey, Jillian Lee — Hydrogen Evolution Catalyzed by Cobaloximes (2011, Dissertation (Ph.D.))
• Bhawe, Yashodhan — I: Solid Materials for Low Temperature Thermochemical Water Splitting. II: Structure-Property Relationships on the Zeolite Catalyzed Conversion of Methanol to Light Olefins (2013, Dissertation (Ph.D.))
• Marshall, Stephen Sandell — Improvement of Integral Membrane Protein Expression via Optimization of Simulated Integration Efficiency (2018, Dissertation (Ph.D.))
• Matson, Benjamin David — Interplay of Proton Transfer, Electron Transfer and Proton-Coupled Electron Transfer in Transition Metal Mediated Nitrogen Fixation (2018, Dissertation (Ph.D.))
• Olmon, Eric Daniel — Investigating DNA-Mediated Charge Transport by Time-Resolved Spectroscopy (2012, Dissertation (Ph.D.))
• Nuñez, Paul Daniel — Investigating Unexpected but Advantageous Integrated Systems for Solar Water Splitting (2021, Dissertation (Ph.D.))
• Fu, Ross — 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 (2014, Dissertation (Ph.D.))
• Aceves, Aiden Joseph — Machine Learning and Modeling Methods for Protein Engineering (2022, Dissertation (Ph.D.))
• Beardslee, Joseph Allen — Magnetic Alignment of High-Aspect Ratio Microwires into Vertical Arrays (2014, Dissertation (Ph.D.))
• Zwang, Theodore Joseph — Magnetic Field Effects and Biophysical Studies on DNA Charge Transport and Repair (2018, Dissertation (Ph.D.))
• Ariosa, Aileen Renia — Mechanisms of Substrate Selection by the Signal Recognition Particle (2014, Dissertation (Ph.D.))
• Davis, Hunter Cole Davis — Mechanistic Insights for Magnetic Imaging and Control of Cellular Function (2020, Dissertation (Ph.D.))
• Hannoun, Kareem Imad — Mechanistic Study of Cu-Mediated, Photoinduced C–S Bond Formation and Demonstration of Electrochemical Ammonia Production by a Surface-Attached Iron Complex (2019, Dissertation (Ph.D.))
• Hong, Qi-Jun — Methods for Melting Temperature Calculation (2015, Dissertation (Ph.D.))
• Kim, Jungwoo — Microfluidic Analysis in Patient Biopsies: toward Precision Medicine for Glioblastoma Multiforme (2018, Dissertation (Ph.D.))
• Kim, Jeongmin — Molecular Simulations of Charge Transport for Energy Storage and Conversion Applications (2022, Dissertation (Ph.D.))
• Weitekamp, Raymond Andrew — Multifunctional Materials: Bottom-Up and Top-Down (2015, Dissertation (Ph.D.))
• Pascal, Tod Augustin — New Approaches to Accurate Predictions of Free Energies: From Proteins to Organic Nanostructures (2010, Dissertation (Ph.D.))
• Allodi, Marco Alberto — On Ultrafast Time-Domain TeraHertz Spectroscopy in the Condensed Phase: Linear Spectroscopic Measurements of Hydrogen-Bond Dynamics of Astrochemical Ice Analogs and Nonlinear TeraHertz Kerr Effect Measurements of Vibrational Quantum Beats (2015, Dissertation (Ph.D.))
• Rosa-Raíces, Jorge Luis — Path Space Markov Chain Monte Carlo Methods for Molecular Simulation (2022, Dissertation (Ph.D.))
• Webb, Michael Anthony — Path-Integral and Coarse-Graining Strategies for Complex Molecular Phenomena (2016, Dissertation (Ph.D.))
• Qiao, Zhuoran — Physics-Informed Neural Approaches for Multiscale Molecular Modeling and Design (2023, Dissertation (Ph.D.))
• Lin, Milo Miaoyu — Protein Folding and Macromolecular Dynamics: Fundamental Limits of Length and Time Scales (2012, Dissertation (Ph.D.))
• Chalkley, Matthew J. — Proton-Coupled Electron Transfer in Nitrogen Fixation (2020, Dissertation (Ph.D.))
• Anderson, Amos Gerald — Quantum Monte Carlo: Faster, More Reliable, and More Accurate (2010, Dissertation (Ph.D.))
• Boekelheide, Nicholas — Quantum Simulation of Enzyme Catalysis (2013, Dissertation (Ph.D.))
• Xie, Hao — Road to Equilibrium: Stable Isotope Distribution in Gaseous Alkanes and Thermal History of Geological Hydrocarbons (2021, Dissertation (Ph.D.))
• Zhang, Bin — Sec-facilitated Protein Translocation and Membrane Integration (2013, Dissertation (Ph.D.))
• Forte, Lila — Statistical Mechanical Framework for Predicting Cellular Response (2016, Master's thesis)
• Cvicek, Vaclav — Structure Prediction of G-Protein Coupled Receptors (2015, Dissertation (Ph.D.))
• Marotta, Christopher Bruno — Structure-Function Studies of Nicotinic Acetylcholine Receptors Using Selective Agonists and Positive Allosteric Modulators (2015, Dissertation (Ph.D.))
• Schild, Dirk Jacob — Synthesis, Characterization, and Reactivity of Iron Hydrides in Nitrogen Fixation and Proton Coupled Electron Transfer from C-H bonds (2022, Dissertation (Ph.D.))
• Finneran, Ian Alan — Terahertz and Microwave Spectroscopy of Liquids and Hydrogen-Bonded Clusters (2017, Dissertation (Ph.D.))
• Kelley, Matthew James — Terahertz Time Domain Spectroscopy of Amino Acids and Sugars (2013, Dissertation (Ph.D.))
• Xu, Chen — The Catalytic and Mechanical Properties of Lithium Battery Electrodes (2017, Dissertation (Ph.D.))
• Theofanis, Patrick Lauren — The Quantum Electron Dynamics of Materials Subjected to Extreme Environments (2012, Dissertation (Ph.D.))
• Witman, Jennifer Elisabeth — The T-Shaped Anisotropic Molecule Model: A Unique Perspective on the Glass Transition and Gelation in Low Valence, Directional, Network Forming Liquids (2010, Dissertation (Ph.D.))
• Krueger, Rachel Ann — Theoretical Characterization of Aromatic Exciplex Fluorescence (2020, Dissertation (Ph.D.))
• Hong, Yun-Hua — Theory of Dynamical Processes in Semiconductor Quantum Dots (2017, Dissertation (Ph.D.))
• Fajardo, Javier, Jr. — Transition Metal Complexes for Challenging Reductive Transformations: From Nitrogen Fixation Catalysts to Photoreductants (2020, Dissertation (Ph.D.))
• Wang, Connie Yuan-Ying — Understanding Co-Translational Protein Targeting and Lithium Dendrite Formation through Free Energy Simulations and Coarse-Grained Models (2016, Dissertation (Ph.D.))
• Boney, Evans T. D. — Vibrational Pooling and Constrained Equilibration on Surfaces (2014, Dissertation (Ph.D.))
• Kimball, Gregory Michael — Zn₃P₂ and Cu₂O Substrates for Solar Energy Conversion (2012, Dissertation (Ph.D.))