20 lines
979 B
Plaintext
20 lines
979 B
Plaintext
# HOW TO EDIT THIS FILE:
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# The "handy ruler" below makes it easier to edit a package description.
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# Line up the first '|' above the ':' following the base package name, and
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# the '|' on the right side marks the last column you can put a character in.
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# You must make exactly 11 lines for the formatting to be correct. It's also
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# customary to leave one space after the ':' except on otherwise blank lines.
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|-----handy-ruler------------------------------------------------------|
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libXCFun: libXCFun (A library of exchange-correlation functionals)
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libXCFun:
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libXCFun:
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libXCFun: XCFun is a library of exchange-correlation (XC) functionals to be
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libXCFun: used in density-functional theory (DFT) codes. XCFun follows a unique
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libXCFun: implementation strategy which enables the computation of derivatives
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libXCFun: of the XC functional kernel up to arbitrary order. It does so by
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libXCFun: relying on forward-mode automatic differentiation.
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libXCFun:
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libXCFun:
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libXCFun:
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