Dears users, i am new user in wien2k community and i need your help i run my case with the version 11.1 but i have
using WIEN2k_11.1 (Release 5/4/2011) in /home/sufyan2020/WIENROOT start (Thu Nov 10 12:58:20 WET 2011) with lapw0 (40/99 to go) cycle 1 (Thu Nov 10 12:58:20 WET 2011) (40/99 to go) > lapw0 (12:58:20) 8.292u 0.108s 0:08.40 99.8% 0+0k 0+3720io 0pf+0w > lapw1 -up (12:58:29) MKL FATAL ERROR on load the function mkl_blas_dpotrf_u_small 0.820u 0.036s 0:01.01 84.1% 0+0k 0+1216io 0pf+0w error: command /home/sufyan2020/WIENROOT/lapw1 uplapw1.def failed > stop error Thank you for helps. Sincerely, sufyan Naji -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20111110/69ca4c0e/attachment.htm>