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proficiency in Density Functional Theory (DFT) and/or Molecular Dynamics (MD) simulations, enabling the computational investigation of material properties, electronic structure, and atomic-scale behavior
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assemblies, ideally with a focus on battery materials. Demonstrated proficiency in Density Functional Theory (DFT) and/or Molecular Dynamics (MD) simulations, enabling the computational investigation
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University of North Carolina at Chapel Hill | Chapel Hill, North Carolina | United States | 3 days ago
to work on accelerated molecular simulations and AI-driven drug discovery. Research projects in the Miao Lab include development of novel theoretical and computational methods and AI techniques
Searches related to molecular dynamics simulation
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