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pyscf
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Complexity
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Issues
A
pyscf\lib\vhf\test\test_nr_direct.py
15 1 -
A
examples\mcscf\13-load_chkfile.py
 2 -
A
pyscf\lib\vhf\time_rev.h
0 1 -
A
pyscf\agf2\aux_space.py
67 1 -
A
pyscf\lo\boys.py
32 11 -
A
examples\adc\06-dfadc.py
 2 -
A
pyscf\lo\edmiston.py
7 3 -
A
pyscf\cc\qcisd_slow.py
23 1 -
A
examples\agf2\06-adc2_solver.py
 1 -
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examples\fci\00-simple_fci.py
 2 -
A
examples\mcscf\43-avas.py
 2 -
A
pyscf\cc\qcisd_t.py
11 2 -
A
examples\mcscf\14-project_init_guess.py
 3 -
A
pyscf\cc\qcisd_t_slow.py
10 1 -
A
examples\mcscf\43-dmet_cas.py
 1 -
A
pyscf\cc\rccsd.py
29 8 -
A
pyscf\cc\rccsd_lambda.py
4 5 -
A
examples\fci\01-given_h1e_h2e.py
 1 -
A
examples\mcscf\44-mcscf_active_space_hamiltonian.py
 1 -
A
pyscf\cc\rccsd_slow.py
131 10 -