9 Commits

Author	SHA1	Message	Date
Paolo Giannozzi	6ee47afe36	[skip-CI] Yet another bug introduced yesterday	2023-12-12 13:33:54 +01:00
Paolo Giannozzi	b70509ac78	[skip-CI] Yet another problem with new PP reading code ... There was an optional variable in routine read_ps_new that is not in a module. This is not standard compliant and may lead to crashes with some compilers.	2023-05-27 10:03:20 +02:00
Paolo Giannozzi	1ed9bf1f3e	[skip-CI] Unclosed file was causing trouble with GTH pseudopotential reading	2023-04-29 14:53:15 +02:00
Paolo Giannozzi	b9ffb6f6de	[skip-CI] More cleanup, GTH PP re-introduced, fixed a crash with PAW	2023-04-27 11:07:57 +02:00
Paolo Giannozzi	ef16fa242b	[skip-CI] More upf cleanup, notably in pseudppotebtial reading. Now all formats ... are read on one processors and broadcast to all others. Temporarily, reading of GTH pseudopotentials is disabled. May still need some further testing.	2023-04-25 10:21:18 +02:00
Paolo Giannozzi	815047d8b9	[skip-CI] More upflib cleanup	2023-04-23 13:10:10 +02:00
Paolo Giannozzi	5bfb5467d5	[skip-CI] Some more upf clean-up, notably in error handling	2023-04-18 17:28:28 +02:00
Paolo Giannozzi	889ecb4a9a	[skip-CI] V.-1 of PSML reading	2023-04-13 18:11:50 +02:00
Paolo Giannozzi	59bf0e41e9	Routine read_ps, used only for conversion, extracted from module upf_mod ... (that can thus be reused for more useful pourposes) and renamed.	2021-03-03 22:12:24 +01:00