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Field
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-Hermitian Systems, Statistical Physics https://sites.google.com/view/moonjippark/home - Prof. Sunwoo Kim (Hanyang University): DMFT, DFT, Strongly Correlated Electron Systems - Prof. Youngseok Kim (Ohio State
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. Advisers name email phone Carelyn E. Campbell [email protected] 301.975.4920 Description First principles electronic structure methods such as density functional theory (DFT) are crucial
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structural techniques for probing the interface, such as SEIRAS and STM, with computational methods to develop new electrochemical models. The computational work focuses on combining DFT methods
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of experimental spectroscopy or diffraction techniques such as XAS, XRD, FTIR, and XPS, of molecular modeling (MD/MC, DFT), and familiarity with basic programming (Python, MATLAB) and the use of Linux/HPC systems
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credits). Practical experience of experimental spectroscopy or diffraction techniques such as XAS, XRD, FTIR, and XPS, of molecular modeling (MD/MC, DFT), and familiarity with basic programming (Python
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-film samples on waveguide interfaces and gas phase samples over temperature ranges from 1.7 K to 350 K. The experimental results are modeled using high-level quantum mechanical methods (DFT/MP2/MRCI
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lifetimes of spins on surfaces. This approach combines electronic states obtained via a periodic quantum embedding (i.e., equation-of-motion coupled-cluster in periodic DFT, pbcEOM-CC) with a coarse-grained
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simulations, density functional theory (DFT), molecular simulations, or machine-learning potentials. Experience with generative AI, active learning, uncertainty quantification, Bayesian optimization
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prevent a true function-by-design approach to development and manufacturing. We are interested in using analytical theory, large-scale molecular dynamics (MD) simulations, and density functional theory (DFT
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and reaction products by standard techniques (NMR, IR, Mass spectrometry, X-ray diffraction, TEM, and DFT calculations also desirable). The Zaleski Lab is a dynamic multidisciplinary laboratory