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LCPQ
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quantum_package
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quantum_package
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src
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Full_CI
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full_ci.ezfio_config
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add CIS full for starting with CIS wave function
2014-07-09 00:41:08 +02:00
full_ci
n_det_max_fci integer
parameters.irp.f
2014-07-09 22:44:42 +02:00
pt2_max double precision
add CIS full for starting with CIS wave function
2014-07-09 00:41:08 +02:00
do_pt2_end logical
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