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remove_duplicated_code
13734786
·
Remove duplicated code.
·
Jun 24, 2022
fix_q0_for_one_and_two_dimensions
48a36eb2
·
if dim < 3, no need to allocate pol from 1:3
·
Jun 27, 2022
fix_clocks_update_exposed_quantity
106d5120
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Fix the previous commit.
·
Jul 08, 2022
573-unit-tests-for-get_vector_potential_mag-routine
c8111155
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add vecpot and magdiff tests
·
Jul 14, 2022
update_code_documentation
9e37fab8
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box update
·
Jul 15, 2022
mft_soc
18486a0f
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do allocations only for BATCH_DEVICE_PACKED
·
Jul 19, 2022
develop
1f263dd8
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Merge branch 'release-12.0' into develop
·
Jul 29, 2022
fix_restart_bugs
bd916f7d
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Write and load oldforce, needed for Verlet propagation of ions
·
Aug 19, 2022
fix_forces
d255ac6c
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Change a condition for the calculation of the nonlocal part of the...
·
Aug 23, 2022
release-12.0
46d8561c
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bumped version number to 12.0
·
Sep 19, 2022
towards_photon_as_system_part2_photon_free
7d3fae5c
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include the px and mollification potential; solve px in both methods (LDA and...
·
Sep 21, 2022
fix_kernels
6985f42f
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The kernel was wrong in case of a global index larger than 32.
·
Sep 22, 2022
soc_gpu_test
9d151472
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simplify the X(projection) logic
·
Sep 26, 2022
call_submesh_init_even_less
9c1e2243
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Added logical flag RecycleSubmesh, by default =no, for recycling the submesh...
·
Sep 27, 2022
stabilize_lcao
dfc8d9c2
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zero out tiny matrix elements
·
Nov 10, 2022
output_dispersive_medium_current
3378c607
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add restart fix and redefine complex alloc
·
Nov 28, 2022
photon_free_exchange_develop_updated
8b7e746a
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Rewriting the wfs potential to be parallel in domain, treat better the...
·
Dec 05, 2022
fix_species_full_gaussian_initialization
a63740af
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Fix the start value for species_full_gaussian
·
Dec 07, 2022
optimize_loewdin
b414385e
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The calculation of the overlap is now made on GPUs when possible.
·
Jan 03, 2023
fix_sync_allstream
88fac51d
·
Fix the routine that synchronize all streams. This was done in an non-elegant and inefficient way.
·
Jan 12, 2023
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