FLAPW code for atomic computations in quantum chemistry and physics
The FLAPW-Method (Full Potential Linearized Augmented Plane Wave Method) is an all-electron method which within density functional theory is universally applicable to all atoms of the periodic table and to systems with compact as well as open structures. It is widely considered to be the most precise electronic structure method in solid state physics.
$
pkg install fleurOrigin
science/fleur
Size
14.3MiB
License
MIT
Maintainer
yuri@FreeBSD.org
Dependencies
10 packages
Required by
0 packages