how to make the space group change?
Posted: Fri Jun 17, 2005 1:07 am
Dear all:
Now I am tring to do some calculation about energy minimization, in INCAR file, I set ISIF=3 and IBRION=2, but why the space group did not change?
Thanks
Now I am tring to do some calculation about energy minimization, in INCAR file, I set ISIF=3 and IBRION=2, but why the space group did not change?
Thanks