Related Issues (20)
- Too big stack arrays in qmckl_compute_een_rescaled_e HOT 1
- Integration of Verificarlo-CI
- MOs
- Safe functions HOT 1
- Include TREXIO in QMCKL
- `qmckl_context_get_range` function is not defined in the `libqmckl.so` library.
- [WIP] Slater Determinant and Local Energy
- Verificarlo-CI -> org
- Compilation : User side improvement HOT 1
- Build install issue
- FAIL : test_qmckl_local_energy HOT 2
- Parallel make
- GPU library
- Non-uniform lists of arguments in the header file HOT 2
- Ignore failures on docs generation HOT 1
- Bug in `qmckl_get_ao_basis_nucleus_index` function HOT 2
- Improvements
- Cutoff probably too high
- make install fails when swig is missing HOT 6
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