Search found 2 matches
- Sat Jan 26, 2013 4:20 am
- Forum: VTSTTools
- Topic: About the two input POSCARS used by nebmake.pl
- Replies: 2
- Views: 8906
- Wed Jan 23, 2013 1:48 pm
- Forum: VTSTTools
- Topic: About the two input POSCARS used by nebmake.pl
- Replies: 2
- Views: 8906
About the two input POSCARS used by nebmake.pl
Are the two poscar files (POSCAR_ls, POSCAR_Fs) must of the same basis vectors, i.e, the cell shape and cell volume must be the same? I got the warning as the following, yqxie@HPC >./nebmake.pl POSCAR_ls POSCAR_Fs 10 filetype1: vasp4 filetype2: vasp4 WARNING: BASIS VECTORS ARE NOT THE SAME BASIS ELE...