xc-info
density-functional theory
Install
- All systems
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curl cmd.cat/xc-info.sh
- Debian
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apt-get install libxc-dev - Ubuntu
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apt-get install libxc-dev - Kali Linux
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apt-get install libxc-dev - Fedora
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dnf install libxc - Windows (WSL2)
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sudo apt-get updatesudo apt-get install libxc-dev - OS X
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brew install libxc - Raspbian
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apt-get install libxc-dev - Dockerfile
- dockerfile.run/xc-info
libxc
density-functional theory
libxc-dev
Library of Exchange-Correlation Functionals (development files)
LibXC is a library of exchange-correlation (XC) functionals for density-functional theory (DFT). The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals that can be used by other codes. This package contains the static library, the C headers and the Fortran modules necessary for developers.