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Diffstat (limited to 'libraries/libvdwxc/slack-desc')
| -rw-r--r-- | libraries/libvdwxc/slack-desc | 19 |
1 files changed, 19 insertions, 0 deletions
diff --git a/libraries/libvdwxc/slack-desc b/libraries/libvdwxc/slack-desc new file mode 100644 index 0000000000..789dc42068 --- /dev/null +++ b/libraries/libvdwxc/slack-desc @@ -0,0 +1,19 @@ +# 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. |