qimpy.dft.electrons.xc.lda
Internal LDA implementations.
Functions
Create Thomas-Fermi kinetic energy functional. |
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Create Slater exchange functional. |
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Create Perdew-Zunger LDA correlation functional. |
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Create Perdew-Wang LDA correlation functional. |
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Create Vosko-Wilk-Nusair LDA correlation functional. |
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Create Teter LSDA functional. |