psi4 / psi4
Files Coverage
__init__.py 100.00%
aliases.py 37.04%
dependency_check.py 78.57%
diatomic.py 57.86%
driver.py 63.07%
driver_cbs.py 85.28%
driver_findif.py 97.34%
driver_nbody.py 95.69%
driver_nbody_helper.py 82.26%
driver_util.py 35.71%
endorsed_plugins.py 97.22%
frac.py 41.48%
gaussian_n.py 99.13%
inputparser.py 58.04%
ipi_broker.py 21.92%
mdi_engine.py 20.62%
molutil.py 91.57%
p4util/__init__.py 100.00%
p4util/exceptions.py 58.24%
p4util/fchk.py 13.64%
p4util/fcidump.py 7.17%
p4util/inpsight.py 49.26%
p4util/numpy_helper.py 90.41%
p4util/optproc.py 76.12%
p4util/p4regex.py 100.00%
p4util/procutil.py 40.93%
p4util/python_helpers.py 79.44%
p4util/solvers.py 87.88%
p4util/spectrum.py 24.14%
p4util/testing.py 95.88%
p4util/text.py 39.53%
p4util/util.py 53.93%
p4util/writer.py 92.86%
pluginutil.py 18.84%
procrouting/__init__.py 100.00%
procrouting/dft/__init__.py 100.00%
procrouting/dft/dft_builder.py 91.90%
procrouting/dft/dh_functionals.py 100.00%
procrouting/dft/gga_functionals.py 100.00%
procrouting/dft/hyb_functionals.py 100.00%
procrouting/dft/lda_functionals.py 100.00%
procrouting/dft/libxc_functionals.py 100.00%
procrouting/dft/mgga_functionals.py 100.00%
procrouting/dft/superfunctionals.py 41.72%
procrouting/empirical_dispersion.py 75.73%
procrouting/findif_response_utils/__init__.py 100.00%
procrouting/findif_response_utils/data_collection_helper.py 17.14%
procrouting/findif_response_utils/db_helper.py 14.08%
procrouting/interface_cfour.py 10.94%
procrouting/libcubeprop/__init__.py 100.00%
procrouting/libcubeprop/cubeprop.py 38.46%
procrouting/mcscf/__init__.py 100.00%
procrouting/mcscf/augmented_hessian.py 89.87%
procrouting/mcscf/mcscf_solver.py 66.67%
procrouting/proc.py 70.54%
procrouting/proc_table.py 100.00%
procrouting/proc_util.py 89.07%
procrouting/response/__init__.py 100.00%
procrouting/response/scf_products.py 90.82%
procrouting/response/scf_response.py 82.24%
procrouting/roa.py 10.42%
procrouting/sapt/__init__.py 100.00%
procrouting/sapt/fisapt_proc.py 73.55%
procrouting/sapt/sapt_jk_terms.py 99.52%
procrouting/sapt/sapt_mp2_terms.py 100.00%
procrouting/sapt/sapt_proc.py 96.36%
procrouting/sapt/sapt_sf_terms.py 93.90%
procrouting/sapt/sapt_util.py 86.61%
procrouting/scf_proc/__init__.py 100.00%
procrouting/scf_proc/scf_iterator.py 88.26%
procrouting/solvent/__init__.py 85.71%
procrouting/solvent/efp.py 98.21%
procrouting/solvent/pol_embed.py 2.68%
psifiles.py 100.00%
qmmm.py 20.69%
schema_wrapper.py 62.96%
util/filesystem.py 63.64%
util/tty/__init__.py 25.81%
util/tty/color.py 34.33%
wrapper_autofrag.py 100.00%
wrapper_database.py 75.76%
Folder Totals (81 files) 70.03%
Project Totals (1472 files) 71.04%
Loading