[Wien] About the warning: R0 for atom 1 Z= 28.00 too big
Dear Colleague, I have same the problem. Have You a solution this problem? I would be plased the help from You. Thanking You in advance, I am Sincerely Yours, Tetyana.
[Wien] errors WIEN2K
Dear Prof. Peter BALAHA I am new user Wien2k. My configuration for Wien2k: Ubuntu 10.10 and Intel Fortran. Compilation is wery vell. I am trying to run SCF in TiC crystal. By x_lstar, I see Commandline: x lstart -up -c Program input is: "13 -6.0 " SELECT XCPOT: recommended: 13: PBE-GGA (