Hi all.
I have run the NEB calculation using vasp after generating the images by using nebmake.pl and after the results ahve converged .. i used nebresults.pl to get the results ..
it gave an error : OUTCAR file not found in folder 00 .. but the VASP run didnt modify the 00 folder at all (no files are created in the 00 folder)
what should I do now ...?
with best wishes
NEB_first taste
Moderator: moderators
Re: NEB_first taste
This is actually a warning. If you use our scripts to generate minimum energy pathways (MEP), they need to know the energy of the initial and final state. By putting the appropriate OUTCAR in 00 and the final folder of the band, your MEP plots will be complete. This will not, however, effect the running of the NEB in vasp.