Commit Graph

8 Commits

Author SHA1 Message Date
Paolo Giannozzi 9155f435ad More upflib cleanup
Implies a small change to EPW - see my comments
2023-10-24 11:11:05 +02:00
Paolo Giannozzi 865f8b848e CUDA Fortran replaced with OpenACC in qvan2
[skip-CI] qvan2_gpu, called in just tree places, re-written with OpenACC,
plus some cleanup of similar routine dqvan2. Seems to work. Next steps:
remove some more CUDA fortran from the three calling routines addusdens,
addusforce, newd_gpu (in particular the latter); merge with non-GPU version.
2023-06-23 18:01:07 +02:00
fabrizio22 235df8dd4d stress_acc - addustress on acc and small omp fix in stres_us 2022-08-08 12:52:05 +02:00
Paolo Giannozzi 29b8eb1bc2 errore => upf_error 2021-04-09 07:57:24 +02:00
Andrea Ferretti a20ee97aff cleanup of commented "using_*" calls 2021-02-22 14:25:53 +01:00
Andrea Ferretti 9eb0babe91 allocations and handling of variables in uspp_data (with special focus on GPU logic) simplified 2021-02-18 17:20:37 +01:00
Andrea Ferretti 53b3a5c6ff us_gpum renamed to uspp_data_gpum (internal consistency) 2021-02-15 19:00:11 +01:00
Andrea Ferretti 9a69f149b9 more files related to PP moved from PW/src to upflib 2021-02-15 10:09:20 +01:00