International Journal

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

Authors

Samuel Francis Boys, Fernando Bernardi

Journal

Molecular Physics

Year Published

1970

Publisher

Taylor & Francis

Citations

22216 citations

Type

Article

Language

EN

Topics & Concepts

Computation (0.79) Reduction (mathematics) (0.57) Energy (signal processing) (0.55) Relation (database) (0.53) Total energy (0.46)

Abstract

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors - Full text available via OpenAlex

Author Details

Samuel Francis Boys

Fernando Bernardi

ORCID

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