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- Qbox is an open-source software package for atomic-scale simulations of molecules, liquids and solids. It implements first principles (or ab initio) molecular dynamics, a simulation method in which inter-atomic forces are derived from quantum mechanics. Qbox is released under a GNU General Public License (GPL) with documentation provided at http://qboxcode.org. It is available as a FreeBSD port. (en)
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- 7620 (xsd:nonNegativeInteger)
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- Francois Gygi, Ivan Duchemin, Jun Wu, Quan Wan, William Dawson, Martin Schlipf, He Ma, Michael LaCount (en)
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- Qbox is an open-source software package for atomic-scale simulations of molecules, liquids and solids. It implements first principles (or ab initio) molecular dynamics, a simulation method in which inter-atomic forces are derived from quantum mechanics. Qbox is released under a GNU General Public License (GPL) with documentation provided at http://qboxcode.org. It is available as a FreeBSD port. (en)
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