Density functional theory augmented with an empirical dispersion term. Interaction energies and geometries of 80 noncovalent complexes compared with ab initio quantum mechanics calculations
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scientific article published on 30 January 2007
scientific article published on 30 January 2007
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Tuesday, January 30, 2007
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"Density functional theory augmented with an empirical dispersion term. Interaction energies and geometries of 80 noncovalent complexes compared with ab initio quantum mechanics calculations" (language: en)
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Petr Jurečka
Dennis R. Salahub
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other details
| description | scientific article published on 30 January 2007 |
External Links
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10.1002/JCC.20570
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17186489
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6614950
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journals/jcc/JureckaCHS07
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