Posted by Dongwen Zhang on September 29, 2013 at 09:43:27:
It seems that MOLCAS v7.8 does not support the ZMAT input. The input on the manual does not work.
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if B is 1s22s22p1, what is Li?
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Comments: : It seems that MOLCAS v7.8 does not support the ZMAT input. The input on the manual does not work.