Analytic second-order energy derivatives in natural orbital functional theory (Q2636448)
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scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Analytic second-order energy derivatives in natural orbital functional theory |
scientific article |
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Analytic second-order energy derivatives in natural orbital functional theory (English)
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5 June 2018
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analytic second-order energy derivatives
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analytic Hessian
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analytic energy gradients
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coupled-perturbed equations
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natural orbital functional theory
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