MSTor: a program for calculating partition functions, free energies, enthalpies, entropies, and heat capacities of complex molecules including torsional anharmonicity (Q483775): Difference between revisions
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| Property / Mathematics Subject Classification ID: 82-04 / rank | |||
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| Property / Mathematics Subject Classification ID: 82-08 / rank | |||
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| Property / Mathematics Subject Classification ID: 82B80 / rank | |||
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| Property / Mathematics Subject Classification ID: 65C05 / rank | |||
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| Property / Mathematics Subject Classification ID: 05B45 / rank | |||
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| Property / Mathematics Subject Classification ID: 80A30 / rank | |||
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| Property / Mathematics Subject Classification ID: 82B30 / rank | |||
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| Property / zbMATH DE Number | |||
| Property / zbMATH DE Number: 6381348 / rank | |||
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| Property / zbMATH Keywords | |||
molecular vibrations | |||
| Property / zbMATH Keywords: molecular vibrations / rank | |||
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chemical kinetics | |||
| Property / zbMATH Keywords: chemical kinetics / rank | |||
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statistical physics | |||
| Property / zbMATH Keywords: statistical physics / rank | |||
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thermodynamics | |||
| Property / zbMATH Keywords: thermodynamics / rank | |||
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| Property / describes a project that uses | |||
| Property / describes a project that uses: LAPACK / rank | |||
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| Property / describes a project that uses: MSTor / rank | |||
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| Property / describes a project that uses: GAUSSIAN / rank | |||
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| Property / MaRDI profile type: MaRDI publication profile / rank | |||
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| Property / full work available at URL: https://doi.org/10.1016/j.cpc.2012.03.007 / rank | |||
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| Property / OpenAlex ID: W2089403525 / rank | |||
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| Property / Wikidata QID: Q57401986 / rank | |||
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| Property / cites work | |||
| Property / cites work: LAPACK Users' Guide / rank | |||
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| Property / DBLP publication ID | |||
| Property / DBLP publication ID: journals/cphysics/ZhengMCT12 / rank | |||
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| links / mardi / name | links / mardi / name | ||
Latest revision as of 04:33, 13 November 2024
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | MSTor: a program for calculating partition functions, free energies, enthalpies, entropies, and heat capacities of complex molecules including torsional anharmonicity |
scientific article |
Statements
MSTor: a program for calculating partition functions, free energies, enthalpies, entropies, and heat capacities of complex molecules including torsional anharmonicity (English)
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17 December 2014
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molecular vibrations
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chemical kinetics
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statistical physics
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thermodynamics
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