-
Cleaning and optimization of the routine lcao_guess_atomic_density 1 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
LCAO optim for k-points 1 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Bugfix: Add the missing mc argument in geometry_init. 1 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Refactor mesh parallelization 3 of 3 checklist items completed
- Merged
-
- 9
- Approved
updated -
Add some checks to avoid integer overflow for cubes 1 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
- Merged
-
- 1
- Approved
updated -
Replace use of box with use of space in several places 0 of 2 checklist items completed
- Merged
-
- 12
- Approved
updated -
Remove one routine only used from one place in mxll 0 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Remove `part_vec` 2 of 2 checklist items completed
- Merged
-
- 5
- Approved
updated -
Improve `mesh_batch_exchange` 2 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Update the pseudo-dojo LDA pseudo tables to version 0.4.1 0 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Improve index conversions 1 of 2 checklist items completed
- Merged
-
- 5
- Approved
updated -
Optimize LCAO for large systems and domain parallelization 1 of 2 checklist items completed
- Merged
-
- 3
- Approved
updated -
- Merged
-
- 9
- Approved
updated -
New lattice_vector type and code refactoring 0 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
- Merged
-
- 1
- Approved
updated -
Add methods to boxes to output information about themselves 0 of 2 checklist items completed
- Merged
-
- 5
- Approved
updated -
Remove the frozen species, which is not used in the code. 1 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
First multisystem propagator for electrons: exponential midpoint 2 of 2 checklist items completed
- Merged
-
- 1
- Approved
updated -
Abstract system of many classical particles 0 of 2 checklist items completed
- Merged
-
- 3
- Approved
updated