[molpro-user] basis set from EMSL

behnam nikoobakht bnikoobakht at yahoo.com
Tue Mar 20 06:21:45 CET 2018


Dear molpro user,
I want to use  basis sets that generated by using EMSL website. I set up a HF calculation for a molecule.I attached my output file. As you can see, there is a problem with my basis set. Does anyone know what is the problem ?

Best regards,Behnam
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