m-a-d-n-e-s-s/madness — pull request #99 by lratcliff (2014-09-08 20:37:38+00:00)
Title: Moldft fixes for input order dependence and 1 electron with libxc

Fix for moldft input order dependence ( issue #2 )
and
Temporary fix for moldft calculations using GGA with only 1 electron - libxc expects more arguments than are present resulting in a crash. The interface should probably be modified for a better solution, for now it simply passes a fake argument.