I would like to check the evolution of the of the forces during the optimization process. Before I was working with vasp vasp.4.6.28
ans I could use a small script such as
egrep 'FORCES: max atom, RMS' OUTCAR | less -N
Now i am using vasp.4.6.31 and the corresponding line of "FORCES: max atom, RMS" is not present anymore in the OUTCAR file.
I looked more in the OUTCAR file and could not find the RMS on the forces, to follow the evolution during the optimization.
I could i do ?
Thank you in advance,
Pierre.
How can I check the Forces
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pmignon
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How can I check the Forces
Last edited by pmignon on Fri Jan 18, 2008 8:29 am, edited 1 time in total.
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support_vasp
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Re: How can I check the Forces
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
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