[molpro-user] Reg: To print transition density matrix for the MCSCF computations

Ganga Periyasamy Ganga.Periyasamy at ulg.ac.be
Wed May 13 16:56:27 BST 2009


Dear molpro users,
I would like to print the transition density matrix between the states for
the root=4 in the mcscf calculations.

is it possible to print the transition density matrix.

thank you
Ganga
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