.. |
.gitignore
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General CCSD
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2019-09-11 17:09:30 +02:00 |
amplitudes.irp.f
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Removed t1, t2
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2019-09-14 14:25:53 +02:00 |
antisymmetrize_ERI.irp.f
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fork CC from mveril and pfloos
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2019-09-09 16:51:15 +02:00 |
cc.irp.f
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Guess amplitudes OK
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2019-09-10 13:35:20 +02:00 |
CCSD_Ec_nc.irp.f
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Cleaning
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2019-09-14 15:07:26 +02:00 |
CCSD.irp.f
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Cleaning
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2019-09-14 15:07:26 +02:00 |
CCSDT.irp.f
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Removed t1, t2
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2019-09-14 14:25:53 +02:00 |
curly_Fock.irp.f
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Removed r1 and r2
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2019-09-14 15:01:09 +02:00 |
curly_W.irp.f
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Removed r1 and r2
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2019-09-14 15:01:09 +02:00 |
denominators.irp.f
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General CCSD
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2019-09-11 17:09:30 +02:00 |
dimensions.irp.f
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fork CC from mveril and pfloos
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2019-09-09 16:51:15 +02:00 |
EZFIO.cfg
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Working on CC
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2019-09-09 17:48:01 +02:00 |
form_abh.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
form_g.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
form_h.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
form_r2.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
form_T.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
form_tau_nc.irp.f
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Removed tau
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2019-09-14 14:32:41 +02:00 |
form_taus_nc.irp.f
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Removed taus
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2019-09-14 14:28:30 +02:00 |
form_ub.irp.f
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Removed t1, t2
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2019-09-14 14:25:53 +02:00 |
form_ubb.irp.f
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Removed t1, t2
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2019-09-14 14:25:53 +02:00 |
integral_batches.irp.f
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General CCSD
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2019-09-11 17:09:30 +02:00 |
Kronecker_delta.irp.f
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fork CC from mveril and pfloos
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2019-09-09 16:51:15 +02:00 |
MP2.irp.f
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Removed nO nV
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2019-09-14 14:15:25 +02:00 |
NEED
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General CCSD
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2019-09-11 17:09:30 +02:00 |
r1_cc.irp.f
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Removed r1 and r2
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2019-09-14 15:01:09 +02:00 |
r2_cc.irp.f
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Cleaning
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2019-09-14 15:07:26 +02:00 |
README.rst
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fork CC from mveril and pfloos
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2019-09-09 16:51:15 +02:00 |
save_energy.irp.f
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fork CC from mveril and pfloos
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2019-09-09 16:51:15 +02:00 |
spatial_to_spin_ERI.irp.f
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Guess amplitudes OK
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2019-09-10 13:35:20 +02:00 |
spatial_to_spin_MO.irp.f
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General CCSD
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2019-09-11 17:09:30 +02:00 |