Optimization algorithm for the generation of ONCV pseudopotentials (Q525641)
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scientific article; zbMATH DE number 6711913
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| English | Optimization algorithm for the generation of ONCV pseudopotentials |
scientific article; zbMATH DE number 6711913 |
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Optimization algorithm for the generation of ONCV pseudopotentials (English)
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5 May 2017
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density functional theory
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pseudopotential
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plane wave
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all-electron calculation
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condensed matter
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0.735369086265564
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0.7058679461479187
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0.6638203859329224
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0.6528151631355286
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0.649389386177063
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