separate K and J from Fock matrix calculation in RHF
**Short description**
Separate the calculation of the Coulomb and Exchange matrix from the function that calculates the Fock matrix in RHF.
**Related issues**
[Coulomb and Exchange matrix python bindings ](https://github.com/GQCG/GQCP/issues/1091)
**To do**
- [x] Create a function for caluclating the Coulomb matrix in RHF in cpp code
- [x] Create a function for calculating the Exchange matrix in RHF in cpp code
合并状态:未合并 关闭于 2025-10-29 1 条评论