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Batchify the imaginary time propagation eigensolver 1 of 1 checklist item completed
- Merged
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- 20
- Approved
updated -
- Merged
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- 2
- Approved
updated -
Add a batch version of Chebyshev expansion of the exponential 2 of 2 checklist items completed
- Merged
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- 10
- Approved
updated -
Several changes simplifying the hamiltonian_elec_apply_* interfaces 1 of 1 checklist item completed
- Merged
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- 3
- Approved
updated -
Cleanup exponential 1 of 1 checklist item completed
- Merged
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- 1
- Approved
updated -
Make methods of basis_set base class public 1 of 1 checklist item completed
- Merged
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- 3
- Approved
updated -
WIP: Resolve "Create abstract class for exponential" 1 of 1 checklist item completed
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Resolve "Create abstract class for hamiltonian" 1 of 2 checklist items completed
- Merged
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- 5
- Approved
updated -
Resolve "Implement new propagator operations for electrons and modify propagators to use it." 1 of 2 checklist items completed
- Merged
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- 1
updated -
Change IO (and restart) for multisystem support 2 of 2 checklist items completed
- Merged
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- 1
- Approved
updated -
Implementation the states abstract class. 1 of 2 checklist items completed
- Merged
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- 4
- Approved
updated -
Resolve "Create abstract class for basis set" 1 of 2 checklist items completed
- Merged
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- 3
- Approved
updated -
- Merged
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- 1
updated -
Changed the components of the casida types from pointers to allocatables. 1 of 1 checklist item completed
- Merged
- 1
- Approved
updated -
Workaround for a problem with ifort 2018.1 and OpenMP. 1 of 2 checklist items completed
- Merged
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- 10
- Approved
updated -
Resolve "Rename parser to namespace" 1 of 2 checklist items completed
- Merged
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- 19
- Approved
updated -
- Merged
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- 2
- Approved
updated -
HGH Projector matrices 1 of 2 checklist items completed
- Merged
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- 12
- Approved
updated -
Enable OpenMP in isf Poisson solver (SGFFT) to increase performance 1 of 1 checklist item completed
- Merged
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- 1
- Approved
updated -
The Ewald long-range for 2D was leading to NaN for energy or forces for thick slabs. 1 of 2 checklist items completed
- Merged
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- 1
- Approved
updated