| 10:50:01 AM PST - Tue, Nov 6th 2012 |
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Quote:Ddcr Nov 5th 4:40 pm
Continuing with this issue I noticed there is an input parameter named translx, that
from the comment on the code I gather this is some empiral correction I can add to bring
the calculated HOMO energies close to the -IP (IP=ionization potential). Is this so?
Thanks again.
Domingos
Yes, translx translates the values on the x-axis. Likewise, transly translates values on the y-axis.
Cheers, Edo
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