Further refinements of next-generation force fields — Nonempirical localization of off-centered points in molecules

Author： Gresh Nohad   Cisneros G. Andrés   Scemama Anthony   Piquemal Jean-Philip  

Publisher： NRC Research Press

ISSN： 1480-3291

Source： Canadian Journal of Chemistry, Vol.91, Iss.9, 2013-01, pp. : 804-810

Disclaimer: Any content in publications that violate the sovereignty, the constitution or regulations of the PRC is not accepted or approved by CNPIEC.

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