Convergence Acceleration Scheme for Self-consistent Orthogonal-basis-set Electronic Structure Methods (Q4415981)
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scientific article; zbMATH DE number 1961074
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Convergence Acceleration Scheme for Self-consistent Orthogonal-basis-set Electronic Structure Methods |
scientific article; zbMATH DE number 1961074 |
Statements
Convergence Acceleration Scheme for Self-consistent Orthogonal-basis-set Electronic Structure Methods (English)
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7 August 2003
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Convergence Acceleration Scheme
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Newton-Raphson algorithm
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Self-consistent Orthogonal-basis-set Electronic Structure Method
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Homo-LUMO Gap
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