EOM-CCSD Dipole expectation values

Seth Olsen seth at spawn.scs.uiuc.edu
Mon Mar 11 20:25:45 GMT 2002


How might MolPro be made to print out dipole operator expectaiton values for the states calculated via EOM-CCSD?  In particular, would the 'gexpec' directive do this?  Is there a card that can be invoked in the EOM-CCSD module?



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