How to get One- and Two-particle density matrices out of non-MCSCF calculations?

Just Got Here	2:31:49 AM PST - Tue, Nov 4th 2014 Dear NWChem community, is there a way to print the One- and Two-particle density matrices to the output for DFT calculations, or any other than MCSCF calculations? Thank you Regards Frank

Forum Vet	5:39:50 PM PST - Tue, Nov 4th 2014 Frank We have not implemented yet the bit of code to compute second-order density-matrix. Unfortunately, we don't have a specific keyword you can use to print the first-order density matrix. The print option "intermediate XC matrix" will print the density matrix plus the XC matrix. dft print "intermediate XC matrix" end task dft

Gets Around	8:49:14 AM PST - Sat, Jan 24th 2015 The two-particle density matrix for a one-electron theory is not interesting. One can compute it from the one-particle density matrix.

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