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% Test case for some of the PSI3 out-of-core codes. Thcode is given only
% 2.0 MB of memory, which is insufficient to hold either the A1 or B2
% blocks of an ovvv quantity in-core, but is sufficient to hold at least
% two copies of an oovv quantity in-core.
%
% TDC, 8/05
psi: (
label = "EOM-CCSD/aug-cc-pVTZ H2O for testing OOC ovvv codes"
wfn = eom_ccsd
memory = (2.0 MB)
reference = rhf
dertype = none
jobtype = sp
cachelev = 0
states_per_irrep = (1 0 0 1)
basis = "aug-cc-pVTZ"
zmat = (
h
o 1 0.9
h 2 0.9 1 104.
)
)
transqt:memory = (5.0 MB)
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