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Add some checks to avoid integer overflow for cubes 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Remove `part_vec` 2 of 2 checklist items completed
- Merged
- 5
- Approved
updated -
Improve index conversions 1 of 2 checklist items completed
- Merged
- 5
- Approved
updated -
Split global indices 0 of 2 checklist items completed
- Merged
- 6
- Approved
updated -
Cleaning ACE 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Remove an unused argument from atom_classical_t. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Increase default number of RMMDIIS iterations to 5 1 of 1 checklist item completed
- Merged
- 1
- Approved
updated -
Minor cleaning of the UserDefinedStates parsing routine. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
LCAO and OEP 1 of 2 checklist items completed
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Preconditioned CG 1 of 2 checklist items completed
- Merged
- 17
- Approved
updated -
Bugfix: f orbitals in the oct_ylm routine. 1 of 2 checklist items completed
- Merged
- 6
- Approved
updated -
Use space%dim 0 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Cleaning of the space module. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Remove single precision related code. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Move the NLCC flag from geometry to epot. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Rename a routine to have a more explicit name. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Remove unnecessary MPI operations. 0 of 1 checklist item completed
- Merged
- 5
- Approved
updated -
Removing the force convergence criteria. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
First implementation of the ACE operator. 2 of 2 checklist items completed
- Merged
- 25
- Approved
updated