CDFTPY: a python package for performing classical density functional theory calculations for molecular liquids (Q2695595): Difference between revisions
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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.2022.108338 / rank | |||
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| Property / OpenAlex ID: W4220866617 / rank | |||
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| Property / Wikidata QID: Q114192688 / rank | |||
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| Property / cites work: Q2845103 / rank | |||
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| Property / cites work: Renormalized site density functional theory / rank | |||
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| Property / cites work: \texttt{NWChem}: a comprehensive and scalable open-source solution for large scale molecular simulations / rank | |||
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Latest revision as of 20:57, 31 July 2024
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | CDFTPY: a python package for performing classical density functional theory calculations for molecular liquids |
scientific article |
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CDFTPY: a python package for performing classical density functional theory calculations for molecular liquids (English)
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31 March 2023
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molecular liquids
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classical density functional theory
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solvated particle
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site density
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reference interaction site model
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renormalized site density functional theory
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