Uz.ytkownik Eyvaz Isaev napisa?: >Hi, > >Use -0.1 instead 0.0 for the last orbital in the >all-electron input file. > >Bests, >Eyvaz. >
Thank you, now it works well with lower damp ie. damp=0.1 Bests, Darek
Uz.ytkownik Eyvaz Isaev napisa?: >Hi, > >Use -0.1 instead 0.0 for the last orbital in the >all-electron input file. > >Bests, >Eyvaz. >
Thank you, now it works well with lower damp ie. damp=0.1 Bests, Darek