In the article below, it says hat WIEN2k version 20.1 wasused. This version is not availabe on the website. I could not find this version. Where can I find it.
Best regards ----- Original Message ----- From: "Rubel, Oleg" <rub...@mcmaster.ca> To: "wien" <wien@zeus.theochem.tuwien.ac.at> Sent: Thursday, March 18, 2021 11:27:40 PM Subject: Re: [Wien] about effective mass It can be related to "WIEN2k compatibility note" in README.md (https://github.com/rubel75/mstar) ________________________________________ From: Wien <wien-boun...@zeus.theochem.tuwien.ac.at> on behalf of Ramazan KATIRCI <ramazankati...@sivas.edu.tr> Sent: Thursday, March 18, 2021 13:36 To: wien Subject: Re: [Wien] about effective mass Hello, Thank you so much, your suggesions about the scratch solved my problem. But another problem emerged. I added the bash output error below. This problem emerged when the mstar program run. The other script (scf, optic etc.) completed normally. Thank you in advance for your help. The bash output: The input file w2_3.mommat2up was found. number of lines in mommat file = 327804 Entering the main loop... ERROR reading the line from mommat file containing 1 1-0.129114E-16-0.348249E-10 0.671895E-17-0.174125E-10 0.313031E-16-0.174125E-10 0.00000000 line number 5 while expecting something like this 1 32 0.270604E-02 0.659085E-03 0.555417E-03-0.308709E-02-0.132694E-11-0.600436E-11 2.35217055 (base) -bash-4.2$ Sincerely Ramazan _______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html _______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
