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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
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processes over such an extended time range is a formidable task for conventional molecular dynamics. We have developed a mathematical technique for simulation of phonon transport in nanomaterials based
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transport, low-temperature Quantum Transport, Photon Scattering, Ab Initio Calculations, Molecular Dynamics, Monte Carlo Simulations, and more. Candidate Profile: The ideal candidate should possess excellent
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many different methodological assumptions, that are currently based around simple single conformations of globular proteins. To address this gap, molecular dynamics (MD) simulations and Neutron
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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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University of North Carolina at Chapel Hill | Chapel Hill, North Carolina | United States | about 2 hours ago
), expertise in computational modeling (such as Molecular Dynamics, virtual screening, free energy calculations and Deep Learning), successful experimental collaboration experiences and excellent communication
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metrology for sequence-controlled polymers. key words polymers; size-exclusion chromatography; polymer synthesis; structure-property relationships; molecular dynamics; rheology; polymer crystallization
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; Materials Genome Initiative; Molecular dynamics; Eligibility citizenship Open to U.S. citizens level Open to Postdoctoral applicants Stipend Base Stipend Travel Allotment Supplementation $82,764.00 $3,000.00
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theoretical treatment. A 4-5 nm nanodiamond is too small for the standard continuum model, which is the usual model for bulk materials. One must use a discrete lattice theory such as the molecular dynamics (MD