Re: [Wien] lapw2 -almd bug in wien2k 21.1

2021-10-25 Thread Peter Blaha
Thank you very much. I've updated my version and hope that this time the fix will make it into the next release. Best regards Peter Am 18.10.2021 um 18:04 schrieb Harrison LaBollita: INTEGER::lmax_to_dmft = 3 -- --

[Wien] lapw2 -almd bug in wien2k 21.1

2021-10-18 Thread Harrison LaBollita
Hi! I’m using wien2k version 21.1. I’m using the utility program dmftproj provided by the authors of the TRIQS software package and I believe that a previous reported bug still remains in the lapw2 routine (previously mentioned here