https://github.com/adc-connect/adcc
Tip revision: 0f4eae7a0e883cbdc1f48a26fe7ef15c04b2e861 authored by Maximilian Scheurer on 01 July 2023, 07:20:59 UTC
Fix problems with scipy and pyscf
Fix problems with scipy and pyscf
Tip revision: 0f4eae7
| File | Mode | Size |
|---|---|---|
| adc_pp | ||
| backends | ||
| guess | ||
| solver | ||
| testdata | ||
| visualisation | ||
| AdcMatrix.py | -rw-r--r-- | 29.0 KB |
| AdcMethod.py | -rw-r--r-- | 3.2 KB |
| AmplitudeVector.py | -rw-r--r-- | 8.1 KB |
| DataHfProvider.py | -rw-r--r-- | 12.0 KB |
| ElectronicTransition.py | -rw-r--r-- | 13.3 KB |
| Excitation.py | -rw-r--r-- | 3.4 KB |
| ExcitedStates.py | -rw-r--r-- | 22.8 KB |
| FormatDominantElements.py | -rw-r--r-- | 3.7 KB |
| FormatIndex.py | -rw-r--r-- | 10.0 KB |
| HfCounterData.py | -rw-r--r-- | 7.7 KB |
| Intermediates.py | -rw-r--r-- | 2.7 KB |
| IsrMatrix.py | -rw-r--r-- | 7.2 KB |
| LazyMp.py | -rw-r--r-- | 11.0 KB |
| MoSpaces.py | -rw-r--r-- | 7.1 KB |
| OneParticleOperator.py | -rw-r--r-- | 14.9 KB |
| OperatorIntegrals.py | -rw-r--r-- | 7.8 KB |
| ReferenceState.py | -rw-r--r-- | 9.0 KB |
| State2States.py | -rw-r--r-- | 3.5 KB |
| Symmetry.py | -rw-r--r-- | 1.6 KB |
| Tensor.py | -rw-r--r-- | 4.2 KB |
| __init__.py | -rw-r--r-- | 6.2 KB |
| block.py | -rw-r--r-- | 1.2 KB |
| conftest.py | -rw-r--r-- | 3.0 KB |
| exceptions.py | -rw-r--r-- | 1.3 KB |
| functions.py | -rw-r--r-- | 7.2 KB |
| hdf5io.py | -rw-r--r-- | 7.1 KB |
| memory_pool.py | -rw-r--r-- | 2.6 KB |
| misc.py | -rw-r--r-- | 6.2 KB |
| opt_einsum_integration.py | -rw-r--r-- | 5.5 KB |
| projection.py | -rw-r--r-- | 15.3 KB |
| setup_environment.sh | -rw-r--r-- | 93 bytes |
| test_AdcBlockView.py | -rw-r--r-- | 2.9 KB |
| test_AdcMatrix.py | -rw-r--r-- | 14.2 KB |
| test_AmplitudeVector.py | -rw-r--r-- | 1.7 KB |
| test_DataHfProvider.py | -rw-r--r-- | 3.7 KB |
| test_ExcitedStates.py | -rw-r--r-- | 5.0 KB |
| test_HartreeFockProvider.py | -rw-r--r-- | 1.5 KB |
| test_IsrMatrix.py | -rw-r--r-- | 4.7 KB |
| test_LazyMp.py | -rw-r--r-- | 7.6 KB |
| test_OneParticleOperator.py | -rw-r--r-- | 12.8 KB |
| test_ReferenceState.py | -rw-r--r-- | 7.2 KB |
| test_ReferenceState_backends.py | -rw-r--r-- | 2.7 KB |
| test_ReferenceState_counterdata.py | -rw-r--r-- | 11.0 KB |
| test_ReferenceState_refdata.py | -rw-r--r-- | 4.9 KB |
| test_Tensor.py | -rw-r--r-- | 6.3 KB |
| test_dense_export.py | -rw-r--r-- | 2.7 KB |
| test_direct_sum.py | -rw-r--r-- | 5.1 KB |
| test_einsum.py | -rw-r--r-- | 6.6 KB |
| test_functionality.py | -rw-r--r-- | 15.1 KB |
| test_functionality_xes.py | -rw-r--r-- | 4.4 KB |
| test_guess.py | -rw-r--r-- | 24.4 KB |
| test_hardcoded.py | -rw-r--r-- | 2.1 KB |
| test_projection.py | -rw-r--r-- | 9.6 KB |
| test_properties.py | -rw-r--r-- | 5.7 KB |
| test_properties_consistency.py | -rw-r--r-- | 3.0 KB |
| test_smoke.py | -rw-r--r-- | 3.9 KB |
| test_state_densities.py | -rw-r--r-- | 7.0 KB |
| test_workflow.py | -rw-r--r-- | 12.0 KB |
| timings.py | -rw-r--r-- | 8.0 KB |
| workflow.py | -rw-r--r-- | 24.6 KB |
