GitHub PushEvent at 2014-07-08 10:58:38
Repository: quantum-espresso
Actor: maxhutch
Payload: {"shas":[["c1b72fa44ff6a8a23d5fadb3f299d4213346bc6a","544bb763fee2d262433691bf0b186713223e3bb8@c92efa57-630b-4861-b058-cf58834340f0","Added TB09 functional, from libxc, courtesy of Eric Germaneau. \nAdded two small files from libxc. Compile with -D__LIBXC, link with libxc:\n-L/dir/where/libxc/is -lxcf90 -lxc\nUser guides updated with a reshuffling of names: contributors to all of QE\n(in particular, most functionals) are listed in the user guide of QE and\nnot in the one of PW. make.depend updated\n\nThis is just to avoid that the work done is lost. It should be a first step \ntowards better organization of XC functionals. We should seriously consider\none of the following options:\n1. move to libxc, getting rid of all duplicated functionals, keeping only\n   those that are not available in libxc;\n2. add the possibility to use any functional from libxc (currently only a few\n   can be used). This may require serious restructuring work in our XC\n   functional (il-)logic, that has become clumsy, obscure and redundant\n\n\ngit-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@11075 c92efa57-630b-4861-b058-cf58834340f0","giannozz",true]],"size":1,"ref":"refs/heads/master","head":"c1b72fa44ff6a8a23d5fadb3f299d4213346bc6a"}