XCFun is a library of exchange-correlation (XC) functionals to be
used in density-functional theory (DFT) codes. XCFun follows a unique
implementation strategy which enables the computation of derivatives
of the XC functional kernel up to arbitrary order. It does so by
relying on forward-mode automatic differentiation.
Maintained by: William PC
Keywords: density-functional,exchange-correlation,kinetic energy
ChangeLog: libXCFun
Homepage:
https://github.com/dftlibs/xcfun
Download SlackBuild:
libXCFun.tar.gz
libXCFun.tar.gz.asc (FAQ)
(the SlackBuild does not include the source)
Individual Files: |
README |
libXCFun.SlackBuild |
libXCFun.info |
slack-desc |
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