Effect of the Solute Cavity on the Solvation Energy and its Derivatives within the Framework of the Gaussian Charge Scheme
© 2019 The Authors. Journal of Computational Chemistry published by Wiley Periodicals, Inc.
| Publié dans: | Journal of computational chemistry. - 1984. - 41(2020), 9 vom: 05. Apr., Seite 922-939 |
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| Auteur principal: | |
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| Format: | Article en ligne |
| Langue: | English |
| Publié: |
2020
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| Accès à la collection: | Journal of computational chemistry |
| Sujets: | Journal Article C-PCM density functional theory implicit solvation |
| Accès en ligne |
Volltext |