A new method for deriving atomic charges and dipoles for n-alkanes: investigation of transferability and geometry dependence

Author： Delhommelle J.   Granucci G.   Brenner V.   Millie P.   Boutin A.   Fuchs A. H.  

Publisher： Taylor & Francis Ltd

ISSN： 1362-3028

Source： Molecular Physics, Vol.97, Iss.10, 1999-11, pp. : 1117-1128

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