[molpro-user] Si(3P) ccsd(t)
pcxams at nottingham.ac.uk
Mon Aug 2 16:11:27 BST 2004
Hello molpro users
I am trying to calculate the energy of the triplet P ground state of Silicon. I wish to freeze the 1s, 2s and 2p orbitals.
I have been using the input :
I am currently trying to repeat a calculation and know what energy I'm after but I seem to be a bit out. Is the above input correct for a 1s 2s 2p frozen core?
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