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Remove unused variable 1 of 2 checklist items completed!1805 13.0
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update HPC tutorials 0 of 2 checklist items completed
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- 42
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Numerical stability Broyden 1 of 2 checklist items completed
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- 16
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Make the periodic_systems/25-Fe_polarized more stable. 1 of 2 checklist items completed
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- 2
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Fix initialization of the eigenvalues. 1 of 2 checklist items completed
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- 1
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Refactoring the PZ SIC and trying to improve the logic of the code in few places. 1 of 2 checklist items completed
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- 12
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Batchify LDA+U commute r 1 of 2 checklist items completed
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- 20
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- 27
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- 34
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Update model tutorials 0 of 2 checklist items completed
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- 2
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Reorganize output routines 1 of 2 checklist items completed
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- 4
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More SOC on GPU 2 of 2 checklist items completed
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- 17
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First attempt at migrating the projection of the non local part of the forces to gpu 2 of 2 checklist items completed!1781 13.0
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- 6
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Bugfix for TDFreezeOrbitals=sae. 1 of 2 checklist items completed
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- 9
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Fix several small bugs for the calculation of the commutator of [r,V_NL] 1 of 2 checklist items completed
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- 3
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Adding the GPU support for DFT+U. 1 of 2 checklist items completed
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- 36
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updated periodic-systems tutorial 0 of 2 checklist items completed
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- 3
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Adding support for OpenMP in xc-related routines. 1 of 2 checklist items completed
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updated