AtomSim: web-deployed atomistic dynamics simulator

AtomSim, a collection of interfaces for computational crystallography simulations, has been developed. It uses forcefield‐based dynamics through physics engines such as the General Utility Lattice Program, and can be integrated into larger computational frameworks such as the Virtual Neutron Facilit...

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Veröffentlicht in:Journal of applied crystallography 2010-12, Vol.43 (6), p.1553-1559
Hauptverfasser: Keith, J. Brandon, Fennick, Jacob R., Nelson, Daniel R., Junkermeier, Chad E., Lin, Jiao Y. Y., Li, Chen W., McKerns, Michael M., Lewis, James P., Fultz, Brent
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Sprache:eng
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