Category:Electronic minimization: Difference between revisions

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**Conjugate gradient optimization: {{TAG|Conjugate gradient optimization}}.
**Conjugate gradient optimization: {{TAG|Conjugate gradient optimization}}.
**Residual minimization scheme, direct inversion in the iterative subspace (RMM-DIIS): {{TAG|RMM-DIIS}}.
**Residual minimization scheme, direct inversion in the iterative subspace (RMM-DIIS): {{TAG|RMM-DIIS}}.
**[[Density mixing]]
**[[Density Mixing|Theory of density mixing]]
*Wrap-around errors in FFT meshes - convolutions: {{TAG|Wrap-around errors}}.
*Wrap-around errors in FFT meshes - convolutions: {{TAG|Wrap-around errors}}.
*Integration of k points: {{TAG|k-point integration}}.
*Integration of k points: {{TAG|k-point integration}}.

Revision as of 12:24, 10 May 2019

Theory

How to