Related Issues (20)
- How to read moden file in ASD calculations HOT 4
- 2 1-rdm
- Natural orbitals for RAS-CI calculation? HOT 1
- ./TestSuite fails without explanation HOT 1
- A question about df_basis HOT 1
- Visualizing Complex-Valued Molecular Orbitals algorithm HOT 1
- A problem with iodine HOT 4
- Issues compiling BAGEL in Ubuntu 20.04.4 LTS HOT 2
- Keyword required for transition metal and actinide atoms HOT 1
- Dyson method not working HOT 1
- Relativistic CASSCF without density fitting HOT 2
- A memory problem with ecp basis sets HOT 1
- Some primitives are missing in cc-pvdz HOT 1
- Problems compilling BAGEL using Boost 1.79.0 HOT 1
- Errors in load_ref HOT 2
- CASSCF calculation on large system HOT 10
- poor performance with AMD Threadripper 3970x HOT 1
- explicitbond error during excited state optimization
- Error encountered when compiling (undefined reference to bagel::Matrix1e ...)
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