From owner-chemistry -x- at -x- ccl.net Mon Oct 31 16:57:00 2011 From: "Muhammed Buyuktemiz mbtemiz3#,#gmail.com" To: CCL Subject: CCL:G: Exchange and coulomb energies in CASSCF Message-Id: <-45790-111031161550-16214-9P5A8PsTgh2xd7Zn/liw3Q__server.ccl.net> X-Original-From: "Muhammed Buyuktemiz" Date: Mon, 31 Oct 2011 16:15:46 -0400 Sent to CCL by: "Muhammed Buyuktemiz" [mbtemiz3:gmail.com] Hello, I am trying to print out exchange and coulomb energies for a casscf calculation. In Gaussian, this can be done for DFT calculations by supplying iop(5/33=1) option, however this has no effect in cas. Is there anyway to print these in gaussian? or in any software? Thank you.