INFO
Name: xcfun-devel
Version: 2.1.1-15.el9
Arch: ppc64le
Summary: Development headers and libraries for XCFun
License: MPL-2.0
Vendor: Fedora Project
Build Host: buildvm-ppc64le-31.iad2.fedoraproject.org
Build Date: Thu Oct 17 08:24:46 2024
Size: 120232
URL: https://xcfun.readthedocs.io
Description: XCFun is a library of approximate exchange-correlation functionals,
used in the Density Functional Theory description of electronic
structure. Because XCFun is based on automatic differentiation the
library can provide arbitrary order derivatives of all supported
functionals. Only the exchange-correlation energy expression needs to
be implemented, which is a huge gain in productivity (and also
efficiency). For this reason the library is very well suited for high
order time dependent DFT or for the development of new functionals.
This package contains the development headers and libraries necessary
to compile code against XCFun.
FILES
/usr/include/XCFun
/usr/include/XCFun/XCFunExport.h
/usr/include/XCFun/XCFunctional.hpp
/usr/include/XCFun/config.hpp
/usr/include/XCFun/densvars.hpp
/usr/include/XCFun/functional.hpp
/usr/include/XCFun/functionals
/usr/include/XCFun/functionals/SCAN_like_eps.hpp
/usr/include/XCFun/functionals/b97c.hpp
/usr/include/XCFun/functionals/b97x.hpp
/usr/include/XCFun/functionals/b97xc.hpp
/usr/include/XCFun/functionals/constants.hpp
/usr/include/XCFun/functionals/list_of_functionals.hpp
/usr/include/XCFun/functionals/m0xy_fun.hpp
/usr/include/XCFun/functionals/pbec_eps.hpp
/usr/include/XCFun/functionals/pbex.hpp
/usr/include/XCFun/functionals/pw92eps.hpp
/usr/include/XCFun/functionals/pw9xx.hpp
/usr/include/XCFun/functionals/pz81c.hpp
/usr/include/XCFun/functionals/revtpssc_eps.hpp
/usr/include/XCFun/functionals/revtpssx_eps.hpp
/usr/include/XCFun/functionals/slater.hpp
/usr/include/XCFun/functionals/tpssc_eps.hpp
/usr/include/XCFun/functionals/tpssx_eps.hpp
/usr/include/XCFun/functionals/vwn.hpp
/usr/include/XCFun/specmath.hpp
/usr/include/XCFun/xcfun.f90
/usr/include/XCFun/xcfun.h
/usr/include/XCFun/xcint.hpp
/usr/lib64/libxcfun.so
/usr/share/cmake/XCFun
/usr/share/cmake/XCFun/XCFunConfig.cmake
/usr/share/cmake/XCFun/XCFunConfigVersion.cmake
/usr/share/cmake/XCFun/XCFunTargets-relwithdebinfo.cmake
/usr/share/cmake/XCFun/XCFunTargets.cmake
REQUIRES
cmake
cmake-filesystem
libxcfun.so.2()(64bit)
rpmlib(CompressedFileNames) 3.0.4-1
rpmlib(FileDigests) 4.6.0-1
rpmlib(PayloadFilesHavePrefix) 4.0-1
rpmlib(PayloadIsZstd) 5.4.18-1
xcfun(ppc-64) 2.1.1-15.el9
PROVIDES
cmake(XCFun) 2.1.1
cmake(xcfun) 2.1.1
xcfun-devel 2.1.1-15.el9
xcfun-devel(ppc-64) 2.1.1-15.el9
CONFIG FILES
/usr/include/XCFun
/usr/include/XCFun/XCFunExport.h
/usr/include/XCFun/XCFunctional.hpp
/usr/include/XCFun/config.hpp
/usr/include/XCFun/densvars.hpp
/usr/include/XCFun/functional.hpp
/usr/include/XCFun/functionals
/usr/include/XCFun/functionals/SCAN_like_eps.hpp
/usr/include/XCFun/functionals/b97c.hpp
/usr/include/XCFun/functionals/b97x.hpp
/usr/include/XCFun/functionals/b97xc.hpp
/usr/include/XCFun/functionals/constants.hpp
/usr/include/XCFun/functionals/list_of_functionals.hpp
/usr/include/XCFun/functionals/m0xy_fun.hpp
/usr/include/XCFun/functionals/pbec_eps.hpp
/usr/include/XCFun/functionals/pbex.hpp
/usr/include/XCFun/functionals/pw92eps.hpp
/usr/include/XCFun/functionals/pw9xx.hpp
/usr/include/XCFun/functionals/pz81c.hpp
/usr/include/XCFun/functionals/revtpssc_eps.hpp
/usr/include/XCFun/functionals/revtpssx_eps.hpp
/usr/include/XCFun/functionals/slater.hpp
/usr/include/XCFun/functionals/tpssc_eps.hpp
/usr/include/XCFun/functionals/tpssx_eps.hpp
/usr/include/XCFun/functionals/vwn.hpp
/usr/include/XCFun/specmath.hpp
/usr/include/XCFun/xcfun.f90
/usr/include/XCFun/xcfun.h
/usr/include/XCFun/xcint.hpp
/usr/lib64/libxcfun.so
/usr/share/cmake/XCFun
/usr/share/cmake/XCFun/XCFunConfig.cmake
/usr/share/cmake/XCFun/XCFunConfigVersion.cmake
/usr/share/cmake/XCFun/XCFunTargets-relwithdebinfo.cmake
/usr/share/cmake/XCFun/XCFunTargets.cmake
LICENSE FILES
MPL-2.0
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