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1-4 of 4 results for ab initio force field

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Research article

First published 2016-2

Predicting the adsorption of n -perfluorohexane ( n -C 6 F 14 ) on BAM-P109 activated carbon using an ab initio force field

Fenglei Cao, Zhifeng Jing, Huai Sun

Adsorption Science & Technology

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Research article

First published 2019-05-18

Qiushuang Xu, Meishan Wang, Gaoshang Li [...]

Main Group Chemistry

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Research article

First published 1994-03

Salvatore Profeta, Rayomand J. Unwalla, Daniel J. Russell

The International Journal of High Performance Computing Applications

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Research article

First published 1990-06

David A. Dixon, William B. Farnham, Patrick J. Capobianco

The International Journal of High Performance Computing Applications