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by time of appointment. The proposed research will leverage multiple computational many-body techniques (including classical and quantum Monte Carlo, molecular dynamics, and ab initio methods) and
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. in chemistry, physics, or related fields • Experience in performing condensed-phase electronic structure calculations and molecular dynamics simulations • Strong communication skills in English
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Science at SDU offers a dynamic research environment, comprising two full professors, one associate professor, one assistant professor, one postdoc, and a large number of PhD students. The project includes strong
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with all institutional training and code of conduct. Ability to work independently based on experience. Knowledge of molecular dynamics simulation and mathematical modeling. Qualifications REQUIRED
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, such as excited state methods, QM/MM simulations, molecular dynamics, simulating spectra, analyzing charges and molecular or environmental configurations, along with experience coding in python. Application
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currently recruiting exceptional doctoral candidates from society. RESPONSIBILITIES Conduct research: Design and execute research projects in any of the following areas: Molecular Simulation: Using molecular
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preferred, but not required) are desired. Experiences with catalysis (biological, homogeneous, or heterogeneous), excited-state simulation methods, multiscale simulations (broadly defined), molecular dynamics
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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