Search found 2 matches

by solarmoon
Sat Jun 04, 2022 1:36 pm
Forum: VTSTTools
Topic: Neb under external stress
Replies: 2
Views: 8195

Re: Neb under external stress

Thank you for the kind reply! So if I want to apply external shear stress, i.e. stress_13, how could I set the stress in INCAR ? Is it by PSTRESS? But in vasp PSTRESS is only set by one value, not a tensor. Thank you very much!
by solarmoon
Tue May 24, 2022 1:06 pm
Forum: VTSTTools
Topic: Neb under external stress
Replies: 2
Views: 8195

Neb under external stress

Dear experts,
I wonder if the VTST code could do neb under constant external shear stress. In vasp, it seems only external isotropic stress can be applpied in vasp as by PSTRESS. Thank you very much!

Best wishes

Chen