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5 lines
324 B
Text
5 lines
324 B
Text
XCFun is a library of exchange-correlation (XC) functionals to be
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used in density-functional theory (DFT) codes. XCFun follows a unique
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implementation strategy which enables the computation of derivatives
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of the XC functional kernel up to arbitrary order. It does so by
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relying on forward-mode automatic differentiation.
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