output of two-particle (coulomb) -integrals

Michael Vogel vogel at int.fzk.de
Tue Dec 9 13:02:59 GMT 2003

Does anybody know how to calculate and print some of the general 
                             < a b | c d >
consisting of four orbitals (e.g. natural orbitals) in Molpro?
The documentation does not yield information about this or I did
not find the answer. The Matrop- and Properties-packets seem not to contain
this feature.
If anybody knows this, please help!

Many thanks,
M. Vogel

More information about the Molpro-user mailing list