kuznetsov at cc.usu.edu
Tue Sep 18 16:57:16 BST 2001
Dear Molpro Users,
I try to do single-point CCSD(T) calculations on P4- structure. Having the
input file structure as follows
(I have the same OCC, CLOSED and WF cards for rhf and rccsd(t) calculations)
I obtain the following in the output file:
Reference energy ...
Correlation energy ...
!RHF-RCCSD ENERGY ...
Available memory in ccsd: 5789844
Min. memory needed in ccsd: 2387180
Max. memory used in ccsd: 3411343
Max. memory used in cckext: 0 (0 integral passes)
Max. memory used in cckint: 1548904 (1 integral passes)
Could anybody please help me with this?
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