An exact reformulation of the diagonalization step in electronic structure calculations as a set of second order nonlinear equations. (Q45985425)
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scientific article published in June 2004
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | An exact reformulation of the diagonalization step in electronic structure calculations as a set of second order nonlinear equations. |
scientific article published in June 2004 |
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An exact reformulation of the diagonalization step in electronic structure calculations as a set of second order nonlinear equations. (English)
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Martin Head-Gordon
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WanZhen Liang
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1 June 2004
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120
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22
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10379-10384
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