Re: [Wien] Error in First SCF cycle

2018-01-26 Thread Gavin Abo
If you're still using some version of composer 2017 as was mentioned previously [1], the "input statement requires too much data" error might be due the Intel compiler version that you are using. You might try googling or searching the Intel forum as that seems to be a known issue with some of

Re: [Wien] Error in First SCF cycle

2018-01-25 Thread Laurence Marks
Almost certainly lapw1 failed. When you have an error, you should always do: 1) cat *.error 2) Look at the end of the relevant output files. Without other information I doubt that anyone can say more, there are many possibilities. On Thu, Jan 25, 2018 at 9:37 AM, mostefa djermouni wrote: > Dear

[Wien] Error in First SCF cycle

2018-01-25 Thread mostefa djermouni
Dear Peter BLAHA and WIEN2K users, I have 80-atoms calculation and after the first cycle of SCF, I got this error :  LAPW0 END  LAPW1 END  LAPW1 END forrtl: severe (67): input statement requires too much data, unit 10, file /home/mostefa/WIEN2k/NOURIA/PFN_17.1/PFN_SCF/PFN/./PFN.vectorup Image