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Removing some useless operations. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Casida: use scalapack or elpa for solving eigenproblem in parallel 2 of 2 checklist items completed
- Merged
- 39
- Approved
updated -
Introduce parallel eigensolver using ScalaPACK or ELPA 1 of 2 checklist items completed
- Merged
- 4
- Approved
updated -
Do subspace diagonalization after eigensolver in SCF 1 of 2 checklist items completed
- Merged
- 6
- Approved
updated -
Change default for StatesBlockSize 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Clean batchified maxwell propagator part 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Resolve "Add more profiling regions in Maxwell code" 0 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Batchification of maxwell propagator routine 2 of 2 checklist items completed
- Merged
- 5
- Approved
updated -
Refactor mxll propagators 1 of 2 checklist items completed
- Merged
- 4
- Approved
updated -
Correct current sign 1 of 2 checklist items completed
- Merged
- 3
updated -
Maxwell ETRS optimization 1 of 2 checklist items completed
- Merged
- 9
- Approved
updated -
Resolve "Optimize Maxwell energy calculation" 0 of 2 checklist items completed
- Merged
- 11
- Approved
updated -
Batchify Maxwell code below exponential_mxll_apply 2 of 2 checklist items completed
- Merged
- 8
updated -
Cleaning Maxwell routines. 1 of 2 checklist items completed
- Merged
- 3
- Approved
updated -
Cleaning of the routine states_mxll_read_user_def. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Resolve "Add profiling regions in Maxwell code" 0 of 2 checklist items completed
- Merged
- 8
- Approved
updated -
consolidating the sequential loops in submesh_init() 2 of 2 checklist items completed
- Merged
- 8
- Approved
updated -
Remove unecessary BCast for write operations. 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
DFT+U: FFT and Psolver Poisson solvers on submeshes 1 of 2 checklist items completed
- Merged
- 4
- Approved
updated -
The ion-ion interaction is now parallelized over atoms. 1 of 2 checklist items completed
- Merged
- 7
- Approved
updated