Pair potential calculation of molecular associations: A vectorized version (Q1366062)
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scientific article; zbMATH DE number 1059472
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Pair potential calculation of molecular associations: A vectorized version |
scientific article; zbMATH DE number 1059472 |
Statements
Pair potential calculation of molecular associations: A vectorized version (English)
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10 November 1997
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molecular associations
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atom-atom potential
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pair potential
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expansion
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geometry optimization
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vectorization
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interacting molecular systems
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simplex
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steepest-descent
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Broyden-Fletcher-Goldfarb-Shanno optimization method
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