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and other complex fluids using molecular simulations. In order to make these simulations more computationally feasible, development of coarse-grained models and new Monte Carlo or molecular dynamics
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Our main research themes are: Life and its Interactions with Dynamic Environments, and Global Landscapes & Climate Change. PhD: 3-4 years full-time; 6-8 years part-time; Thesis of Max 80,000 words
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Description Molecular modeling (i.e., Monte Carlo and molecular dynamics methods) are becoming computationally-accessible for large-scale simulations of various thermophysical and mechanical properties
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(AI), health informatics, health information and communication, epidemiology, environmental engineering, systems modeling, natural language processing, and machine learning and a strong desire to grow
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). DOI: 10.1021/acs.jpcc.7b07769 Modeling; Simulation; Computational Chemistry; Molecular Dynamics; Coarse-Grained Modeling; Soft Materials; Polymer Dynamics; Polymer Glasses; Polymer Composites; Colloids
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are structurally and chemically characterized using standard analytical techniques and are modeled using molecular simulations. Techniques used to structurally and chemically characterize the sorbent materials
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molecular dynamic calculations) will be needed to develop these types of models. Some of the complex material systems of interest are metallic glasses, nanocrystalline metals, hydrogen storage materials
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transport, low-temperature Quantum Transport, Photon Scattering, Ab Initio Calculations, Molecular Dynamics, Monte Carlo Simulations, Photonics simulation, metamaterials, and more. Candidate Profile: The
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Calculations, Molecular Dynamics, Monte Carlo Simulations, Photonics simulation, metamaterials, and more. Candidate Profile: The ideal candidate should possess excellent training in computational nuclear physics
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responsible for the observed properties. The results obtained are then used to develop models that can be used to simulate systems with up to hundreds of thousands of atoms. Monte Carlo and molecular dynamics