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Create and use MPI wrappers to encapsulate most of the MPI functionality 1 of 1 checklist item completed
- Merged
- 12
- Approved
updated -
- Merged
- 1
- Approved
updated -
- Merged
- 1
- Approved
updated -
Add and use new kind definitions for 32 and 64 bit integers and reals 1 of 1 checklist item completed
- Merged
- 12
- Approved
updated -
Fix all MPI function calls to match interfaces and make MPI module default 1 of 1 checklist item completed
- Merged
- 1
- Approved
updated -
Safeguard for phase and boundary conditions 0 of 2 checklist items completed
- Merged
- 2
- Approved
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Adding a unit test for the interpolation scheme used in the multigrid scheme. 2 of 2 checklist items completed
- Merged
- 6
- Approved
updated -
Generalized Kohn-Sham and MGGA from OEP 1 of 2 checklist items completed
- Merged
- 2
- Approved
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Explicit KLI for noncollinear spins 2 of 2 checklist items completed
- Merged
- 5
- Approved
updated -
Slater from exchange operator 1 of 2 checklist items completed
- Merged
- 6
- Approved
updated -
QMR tolerance 1 of 2 checklist items completed
- Merged
- 1
- Approved
updated -
Refactor grid generation: generate indices locally and optionally use a space-filling Hilbert curve 2 of 2 checklist items completed
- Merged
- 60
- Approved
updated -
- Merged
- 1
- Approved
updated -
- Merged
- 1
- Approved
updated -
- Merged
- 1
- Approved
updated -
Refactor comm_allreduce 2 of 2 checklist items completed
- Merged
- 7
- Approved
updated -
Refactor mesh parallelization 3 of 3 checklist items completed
- Merged
- 9
- Approved
updated