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
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Doc	1. Extension of the HP code to compute also inter-site V (DFT+U+V case)	2020-04-17 11:01:51 +00:00
examples	1. Extension of the HP code to compute also inter-site V (DFT+U+V case)	2020-04-17 11:01:51 +00:00
src	First compiling version of QE with initial "pseudolib" in upflib/.	2020-04-25 19:13:15 +00:00
Makefile	Implementation of the new code hp.x to compute Hubbard U from DFPT.	2018-08-29 14:54:42 +02:00