# HOW TO EDIT THIS FILE: # The "handy ruler" below makes it easier to edit a package description. # Line up the first '|' above the ':' following the base package name, and # the '|' on the right side marks the last column you can put a character in. # You must make exactly 11 lines for the formatting to be correct. It's also # customary to leave one space after the ':' except on otherwise blank lines. |-----handy-ruler------------------------------------------------------| libvdwxc: libvdwxc (A library for vdW-DF exchange-correlation functionals) libvdwxc: libvdwxc: libvdwxc is a general library for evaluating energy and potential libvdwxc: for exchange-correlation (XC) functionals from the vdW-DF family libvdwxc: that can be used with various of density functional theory (DFT) libvdwxc: codes. This work was inspired by success of libXC, a library for libvdwxc: local and semilocal XC functionals. At the moment, libvdwxc provides libvdwxc: access to the DF1, DF2, and CX functionals and interfaces for GPAW libvdwxc: and Octopus. The library has been tested with respect to the S22 libvdwxc: test set, various bulk properties of metals and semiconductors, libvdwxc: and surface energies.