Queries about input and output files, running specific calculations, etc.
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rudra-b
#1
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by rudra-b » Mon Aug 27, 2007 5:16 pm
hello friends,
i want to know one thing: do VASP read the INCAR file in every step of geometric convergence? i.e. if I change the value of a parameter in INCAR after calculation started, do the change effect the calculation or it continues with previous value?
Last edited by rudra-b on Mon Aug 27, 2007 5:16 pm, edited 1 time in total.
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dcurulla
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#2
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by dcurulla » Tue Aug 28, 2007 11:20 am
Hi,
I think that INCAR file is only read once at the beginning of the calculation.
Cheers
Last edited by
dcurulla on Tue Aug 28, 2007 11:20 am, edited 1 time in total.
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admin
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#3
Post
by admin » Wed Aug 29, 2007 11:07 am
INCAR is only read at the beginning of a vasp-run
Last edited by
admin on Wed Aug 29, 2007 11:07 am, edited 1 time in total.