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8 lines
379 B
Plaintext
8 lines
379 B
Plaintext
libvdwxc is a library of density functionals, which can be linked by density
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functional theory (DFT) codes, to enable the calculation of exchange and
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correlation energies for van der Waals density functionals (vdW-DF). libvdwxc
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evaluates correlation energy and potential using a convolution in Fourier space
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using the method by Roman-Perez and Soler.
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WWW: https://libvdwxc.org/
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