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Issues
A
pyscf\pbc\tools\test\test_k2gamma.py
9 2 -
A
pyscf\cc\test\test_gccsd_lambda.py
9 1 -
A
pyscf\fci\selected_ci_spin0_symm.py
9 3 -
A
pyscf\pbc\cc\test\test_kuccsd.py
8 2 -
A
pyscf\pbc\cc\__init__.py
8 7 -
A
pyscf\pbc\tdscf\test\test_rhf_slow.py
8 1 -
A
pyscf\x2c\test\test_x2c.py
8 5 -
A
pyscf\x2c\sfx2c1e_hess.py
8 6 -
A
pyscf\symm\test\test_sph.py
8 2 -
A
pyscf\scf\ucphf.py
8 3 -
A
pyscf\scf\test\test_vhf.py
8 1 -
A
pyscf\mcscf\test\test_c2h4.py
8 1 -
A
examples\qmmm\30-force_on_mm_particles.py
8 2 -
A
pyscf\sgx\test\test_sgx_jk.py
8 6 -
A
pyscf\lib\np_helper\np_helper.c
8 1 -
A
pyscf\gw\__init__.py
8 2 -
A
pyscf\pbc\gto\_pbcintor.py
8 2 -
A
pyscf\gto\ecp.py
8 5 -
A
pyscf\ao2mo\test\test_init.py
8 3 -
A
pyscf\ao2mo\test\test_r_outcore.py
8 2 -