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Re^2: Adding the coordinates from the first Optimization run to the next calculation.....
Siddheshwar Chopra
sidhusai@gmail.com
Dear Luca,
First of all many thanks for taking pains to make these files and helping me in understanding. Please clarify the following:
1) What does IFDMOD=2 STRICT=.T. mean in $ZMAT?
2) I would be grateful if you could send me the input file which demonstrate how to use the coordinates of PREVIOUS run in the future run. I read the PUNCH, IRCDATA files, but would appreciate if you could show me how to use their outputs in the further runs.Regards,
On Thu Dec 27 '12 9:12pm, Luca Maidich wrote
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>I forgot the attachment. Sorry.
>Luca
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Sat Dec 29 '12 5:15pm
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