Hi,
I made two single point calculations on a same system, one with the LREAL = On tag and the other with LREAL =.TRUE., all other parameters unchanged. Although both OUTCAR files show LREAL = T, the two electronic energies are different by about 2 eV. Could you please comment on that ?
I'm using vasp.5.3.3.
Thanks.
MCV
LREAL = On != LREAL = .TRUE.
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MCV
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LREAL = On != LREAL = .TRUE.
Last edited by MCV on Fri Nov 22, 2013 9:58 am, edited 1 time in total.
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support_vasp
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Re: LREAL = On != LREAL = .TRUE.
Hi,
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