pymolresponse/__init__.py,sha256=JfgDnDW9E109vxFUBSrj0xvUg77qAJY7Cu720lgoZPA,129
pymolresponse/_version.py,sha256=r4xAFihOf72W9TD-lpMi6ntWSTKTP2SlzKP1ytkjRbI,22
pymolresponse/ao2mo.py,sha256=WQ2SizW65jB2odrQi20RciA7Uow2y6h7LZbhuvPQERI,2971
pymolresponse/constants.py,sha256=ecO1KscwOPfawgEH3_76oEyb7PirNi1p5aXsoJhYr-c,1266
pymolresponse/core.py,sha256=SaVDVB0anJrX2yLze9dIgP8lubJFoYxZNKln26B7kQk,1578
pymolresponse/cphf.py,sha256=lpW7DNUhk5x9DoFI8KzvPJSQ0adqTBZtqYJ-QuYvMjw,10935
pymolresponse/explicit_equations_full.py,sha256=AC792TN524ieVD1F0xzKz6uGv4X32gi81ZAuiDRhR34,6551
pymolresponse/explicit_equations_partial.py,sha256=cXOEZq_uuwC2vXLJBaURMA-CRY86X2Hr0Y4qkfIfdcg,5976
pymolresponse/helpers.py,sha256=g_xSVFTRtgm5d0q2U6tXXualgDaXq698qW4Kf_ZRFLM,3920
pymolresponse/integrals.py,sha256=Oonvs__p_HwdNVrKxNQhvUqtWftHfmowvUKn6GLMvzQ,8488
pymolresponse/molecular_property.py,sha256=NqtoIxVkT0yWKWiGtQENl6JE288FkCrn-IqC4rCRPOI,3036
pymolresponse/operators.py,sha256=l3N0hb3uGHJjfCQz4Lt_riz4a2xiTMbvQJuHR82HM7E,5722
pymolresponse/py.typed,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/solvers.py,sha256=1wZeJky5QJtIhZTbUiwR4HvW3s-ZRCSYvJtCB9pdmQw,43312
pymolresponse/td.py,sha256=FeQ5CztIF0jiM2XoFv_fo_LizjUSf8lVsOrcFxpJgRk,10497
pymolresponse/utils.py,sha256=YRricpApc3bqn2KLU34rh-dP8bqg1pvLtBiWuBPvwAw,13043
pymolresponse/data/__init__.py,sha256=L0u0HJouu5uG6VlTOq9_cbGf905cvw_CcowhL_e_52Y,155
pymolresponse/interfaces/dalton/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/interfaces/dalton/utils.py,sha256=8pe_sPuGhOV217WS-fJYM1OmEJb6VK5MCTVYWwNsk5o,3056
pymolresponse/interfaces/psi4/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/interfaces/psi4/integrals.py,sha256=cl_LLRgha3gIjOqmhO6xrmH5xkwggl67hwUDKs71fyM,4512
pymolresponse/interfaces/psi4/molecules.py,sha256=rVwV_aRCbKhTtszAlC1zk4szOwMICZhIXVO6xbWyZVM,4358
pymolresponse/interfaces/psi4/utils.py,sha256=BimyA6C_RaOD4dL0E2o5FjyChgWoIqo45OXqMRVXdvg,1174
pymolresponse/interfaces/pyscf/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/interfaces/pyscf/ao2mo.py,sha256=uPgb38Yndl_68wKXPa3lVpMa-x42wmzMxsX-JTc-pV8,4588
pymolresponse/interfaces/pyscf/helpers.py,sha256=mnRodMILfmtNoue-RU4kifw4tKQJkNp1e6hACA2kPV8,5848
pymolresponse/interfaces/pyscf/integrals.py,sha256=cHWFCo5v5M3ZwlDiKIUZ6sXDmrp_VBrEBS2ApEdYFoY,1568
pymolresponse/interfaces/pyscf/molecules.py,sha256=GNcJxIlAQeqJWOQgTjvxGtImlRTG5IQjEEI22mYADpk,3864
pymolresponse/interfaces/pyscf/utils.py,sha256=EchET5mwzMOlGVdm_zdoNAJ88uNo6age05EbqJAEids,437
pymolresponse/properties/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/properties/ecd.py,sha256=UhiOnnEP6Xu3PrUbA46ls1kRqSZJo0MvbXJ5hOdHddo,14264
pymolresponse/properties/electric.py,sha256=GXSQQ0tK7m-qFri1VJJqV-72ZB3pAkWdoFXh3SYvwS4,1876
pymolresponse/properties/magnetic.py,sha256=gYh_OEPaZiU9BSpnMOiWcG8taRsdn_EyvI-CmGK77FI,7942
pymolresponse/properties/optrot.py,sha256=RJOvbTefFB6Aa20lSQiKK_YzrS91VQaxgUyuqkUpQU8,3430
pymolresponse/tests/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
pymolresponse/tests/test_ao2mo.py,sha256=NRwPCIvfMr-xttbTFLGT3C_yuzulkGejR3pNu3KjbUc,3743
pymolresponse/tests/test_calculators.py,sha256=fu9oY892XdidWZJFWmJB3GXKPN81AoND7LlvoJqhncA,14875
pymolresponse/tests/test_final_result.py,sha256=rEdbD3w5-mc5vYkNe1TSyrRPMvZg8EZ-kfDcCgQpMRs,14193
pymolresponse/tests/test_hydrogen.py,sha256=jIR9aiWguFVBe2_ExGSnPz4nfe24nGKLWMRlpoKi0oA,690
pymolresponse/tests/test_molecular_property.py,sha256=XFLja7P5w0Pq6_rcz0UlNZPNqU5k37HqJSyVB3ZJif4,2360
pymolresponse/tests/test_operators.py,sha256=-402B9qLVGWiMm3F5qObyjNWjrzRuimTquE_24al2fI,2243
pymolresponse/tests/test_rhf.py,sha256=3nU9OMDMt84XE9XNXTKueCC5URMXnXICGQhQBOJfBmE,4458
pymolresponse/tests/test_runners.py,sha256=fVfjeldhPIGb6I28W2Rb7Wa9LompU7PxXT38Ba-h5a4,3612
pymolresponse/tests/test_solvers.py,sha256=eb-6Xm0_Onu7o1UBnPRkjJgrjWgdpLIKwPChtov9s6E,3949
pymolresponse/tests/test_td.py,sha256=pGd6CM2POGu5O0iz36g1Ah_tXE0iV1AYvpDxlnceFlQ,4701
pymolresponse/tests/test_uhf.py,sha256=hb2v4eFT7NnyHCZABOzYQIqd2paDpoX7X1pSWzdiyvg,11238
pymolresponse/tests/test_uhf_partial_mo_trafo.py,sha256=79Um2Cc0fRY0UXpNr52VbC2LVqBibpWJLhGKlf0hnOU,9058
pymolresponse/tests/test_uncoupled.py,sha256=UA7d1EuIAf8kLHSixnvNlioislVLzfKnLFA1i6UgW2o,8861
pymolresponse/tests/test_utils.py,sha256=qv6RYd1oKF9aCmFyPI-vBJY2RjgK2U7_qIrlVfgdtdE,1495
pymolresponse/tests/properties/test_ecd.py,sha256=Z0rL8O4SzJ4FtqAELjcKI0wpGbl7KhEKJNJxjetUmZ8,10807
pymolresponse/tests/properties/test_geometric_hessian.py,sha256=x6zDmykCpLitp80DeO473c80_Blpw21W5m2xLeNDUe4,38508
pymolresponse/tests/properties/test_magnetic.py,sha256=ZBcJf7VTSqakS8fYu-GKl5GU1xor5vXU3ixmruVqXI4,6392
pymolresponse/tests/properties/test_optrot.py,sha256=FnCCPCBVUMrFBz8gZO-AhOTxy_pgpw30wstzs_xeIvg,11584
pymolresponse/tests/properties/test_quadratic.py,sha256=P7UIUVZ3t5tVyC1AMfrY2-Cave9L5PIh9KNx5Nttx2c,44254
pymolresponse/tests/properties/test_quadratic_psi4numpy.py,sha256=6NuNIGW5R4FTpmdk9OneoVjy7TATt7wpaacCxNnoRHM,35609
pymolresponse/tests/psi4/test_integrals_psi4.py,sha256=q1pZYz6qk7HZlL5SD_SNITSIoZxWU4AjU1PLw6JHo3Q,1620
pymolresponse/tests/pyscf/test_integrals_pyscf.py,sha256=Me4X_ngKVsTF59P5Mq_GJ3DR23x5sbvvHbpxt_zZG_E,711
pymolresponse-0.3.1.dist-info/licenses/LICENSE,sha256=Z7Ofecpu5iS1fDMMXDbMqqJsECiC2_L3SSBgSc336KY,1513
pymolresponse-0.3.1.dist-info/METADATA,sha256=XkRnit1QCGJHsPsEiCWPBbPjIBlPotsZ7mT2LTnSEL8,6295
pymolresponse-0.3.1.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
pymolresponse-0.3.1.dist-info/top_level.txt,sha256=Lby58rirNXN4_BOAc660jLyB0U2mXGZy5claEiranHw,14
pymolresponse-0.3.1.dist-info/RECORD,,
