Convergence analysis of adaptive DIIS algorithms with application to electronic ground state calculations (Q5034831)
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scientific article; zbMATH DE number 7477262
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| English | Convergence analysis of adaptive DIIS algorithms with application to electronic ground state calculations |
scientific article; zbMATH DE number 7477262 |
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Convergence analysis of adaptive DIIS algorithms with application to electronic ground state calculations (English)
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21 February 2022
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fixed-point iteration
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Anderson acceleration
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DIIS
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nonlinear GMRES
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quantum chemistry
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0.8336307406425476
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0.8048318028450012
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0.7716723680496216
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0.7701760530471802
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0.728866696357727
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