Requests for technical support from the VASP group should be posted in the VASP-forum.


From Vaspwiki
(Redirected from ML FFCAR)
Jump to navigationJump to search

This file contains the force field information.

It is needed to run calculations using force fields only (ML_FF_ISTART=2).

A knewly created force field with ML_FF_ISTART=0 or ML_FF_ISTART=1 is written to the ML_FFN file. This file has to be copied or moved to ML_FF for a force field only calculation.