A constrained optimization algorithm for total energy minimization in electronic structure calculations (Q2508902)
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scientific article; zbMATH DE number 5066054
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| English | A constrained optimization algorithm for total energy minimization in electronic structure calculations |
scientific article; zbMATH DE number 5066054 |
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A constrained optimization algorithm for total energy minimization in electronic structure calculations (English)
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20 October 2006
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electronic structure calculation
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total energy minimization
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nonlinear eigenvalue problems
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constrained optimization
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0.8122224807739258
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0.8036762475967407
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0.7814339399337769
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0.7735937237739563
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0.7692498564720154
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