Ab initio quantum mechanics/molecular mechanics method with periodic boundaries employing Ewald summation technique to electron-charge interaction: Treatment of the surface-dipole term
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| Description | scientific article published on 01 March 2019 |
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author: Kimihiko Hirao Yukio Kawashima Kazuya Ishimura Motoyuki Shiga |
| Publication date | March 1, 2019 |
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