How To Install xcfun-devel on Fedora 36

In this tutorial we learn how to install xcfun-devel in Fedora 36. xcfun-devel is Development headers and libraries for XCFun

Introduction

In this tutorial we learn how to install xcfun-devel on Fedora 36.

What is xcfun-devel

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.

We can use yum or dnf to install xcfun-devel on Fedora 36. In this tutorial we discuss both methods but you only need to choose one of method to install xcfun-devel.

Install xcfun-devel on Fedora 36 Using dnf

Update yum database with dnf using the following command.

sudo dnf makecache --refresh

After updating yum database, We can install xcfun-devel using dnf by running the following command:

sudo dnf -y install xcfun-devel

Install xcfun-devel on Fedora 36 Using yum

Update yum database with yum using the following command.

sudo yum makecache --refresh

After updating yum database, We can install xcfun-devel using yum by running the following command:

sudo yum -y install xcfun-devel

How To Uninstall xcfun-devel on Fedora 36

To uninstall only the xcfun-devel package we can use the following command:

sudo dnf remove xcfun-devel

xcfun-devel Package Contents on Fedora 36

/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/lib/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

References

Summary

In this tutorial we learn how to install xcfun-devel on Fedora 36 using yum and [dnf]((/fedora/36/dnf/).

title: “How To Install xcfun-devel on Fedora 36” linkTitle: “xcfun-devel” type: “docs” description: “In this tutorial we learn how to install xcfun-devel in Fedora 36. xcfun-devel is Development headers and libraries for XCFun” date: “2022-08-17” lastmod: “2022-08-17” #image: /images/fedora/36/xcfun-devel-featured.png

Introduction

In this tutorial we learn how to install xcfun-devel on Fedora 36.

What is xcfun-devel

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.

We can use yum or dnf to install xcfun-devel on Fedora 36. In this tutorial we discuss both methods but you only need to choose one of method to install xcfun-devel.

Install xcfun-devel on Fedora 36 Using dnf

Update yum database with dnf using the following command.

sudo dnf makecache --refresh

After updating yum database, We can install xcfun-devel using dnf by running the following command:

sudo dnf -y install xcfun-devel

Install xcfun-devel on Fedora 36 Using yum

Update yum database with yum using the following command.

sudo yum makecache --refresh

After updating yum database, We can install xcfun-devel using yum by running the following command:

sudo yum -y install xcfun-devel

How To Uninstall xcfun-devel on Fedora 36

To uninstall only the xcfun-devel package we can use the following command:

sudo dnf remove xcfun-devel

xcfun-devel Package Contents on Fedora 36

/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

References

Summary

In this tutorial we learn how to install xcfun-devel on Fedora 36 using yum and [dnf]((/fedora/36/dnf/).