Minimal set of molecule-adapted atomic orbitals from maximum overlap criterion (Q395285): Difference between revisions
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| Property / Mathematics Subject Classification ID: 92E10 / rank | |||
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| Property / zbMATH DE Number: 6251717 / rank | |||
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minimal basis set | |||
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partial atomic charges | |||
| Property / zbMATH Keywords: partial atomic charges / rank | |||
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molecule-intrinsic orbitals | |||
| Property / zbMATH Keywords: molecule-intrinsic orbitals / rank | |||
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Revision as of 16:07, 29 June 2023
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Minimal set of molecule-adapted atomic orbitals from maximum overlap criterion |
scientific article |
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Minimal set of molecule-adapted atomic orbitals from maximum overlap criterion (English)
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29 January 2014
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minimal basis set
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partial atomic charges
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molecule-intrinsic orbitals
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