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research on 2D materials, including ferroelectric, multiferroic, topological, and moiré systems. Develop, implement, and apply advanced simulation techniques (e.g., density functional theory, tight-binding
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and development activities in the fields of atomistic simulations, including density functional theory, machine learning, and molecular dynamics. The work involves theoretical and experimental research
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field. Demonstrated ability to perform research that addresses fundamental science questions. Demonstrated experience with computational chemistry methods including density functional theory, molecular
Searches related to density functional theory molecular dynamics
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