quantum-espresso/NEB
giannozz 1b072fbc4f First compiling version of QE with initial "pseudolib" in upflib/.
Most of the changes consist in small updates to Makefile and make.depend and
in the replacement of module "parameters" with "upf_params" whenever variables
lmaxx and lqmax are USEd. Routine "read_pseudo" moved back to Modules/;
"simpsn" moved to upflib/; a copy of "matches" temporarily added to upflib/

Note that everything compiles (except EPW) but nothing has been tested yet!
2020-04-25 19:13:15 +00:00
..
Doc A few more changes so that "make gui" creates a functional PWgui. 2019-03-01 23:44:12 +01:00
examples Cleanup of parallel modules: 2019-01-31 15:51:00 +01:00
src First compiling version of QE with initial "pseudolib" in upflib/. 2020-04-25 19:13:15 +00:00
tools NEB has new dir structure. Doc is not complete. 2011-08-12 08:29:45 +00:00
Makefile make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00