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fa7877e2
·
Make sure species is not initialized twice, as second time would give an incorrect results.
·
Jun 11, 2021
use_hilbert_indexing
608bc9d6
·
Decrease eigensolver tolerance in two tests
·
Jun 11, 2021
fix_tolerance_23-hybrids
b6a4daaa
·
Fix some tolerances
·
Jun 11, 2021
453-merging-mean-field-multi-mode-electron-photon-time-propagation
1b132e36
·
Merge remote-tracking branch 'origin/develop' into...
·
Jun 11, 2021
change_default_poisson_gpu
1283fdc7
·
Disable FFT on GPUs for multipole_correction kernel
·
Jun 10, 2021
fix_instability_lcao
178d43a5
·
In some cases, Lapack can complain that the overlap matrix is not...
·
Jun 10, 2021
cleaning_states_elec_calc_quantity
ec0c93d1
·
Cleaning of the states_elec_calc_quantity to be slightly more readable.
·
Jun 10, 2021
dft_u_full_delta
012deb04
·
Add the possibility to compute the +U (and +V) using a species full delta....
·
Jun 09, 2021
fix_wannier90
1abcc6aa
·
The case for rr=0 for s orbitals was not done properly.
·
Jun 09, 2021
use_phse_correction
48468267
·
Fix the argument for the preconditioner_apply_batch call in the QMR dotp solver.
·
Jun 08, 2021
change_default_statespack_gpu
c765bb2f
·
Make StatesPack=yes the default on GPUs
·
Jun 08, 2021
meisam.tabriz-develop-patch-19273
69c551ec
·
Fix mpi_debug_in/out call_counter indexes
·
Jun 07, 2021
fix_hybrids
53fdf447
·
Bugfixes for hybrid functionals
·
Jun 03, 2021
noncollinear_becke_roussel
7a26e3b6
·
Minor cleaning.
·
Jun 02, 2021
combined_xc_derivatives
301b2f2b
·
temporarily commented out declarations to avoid warnings
·
Jun 02, 2021
hotfix-10.5
f9f68448
·
updated version number to 10.5
·
May 31, 2021
master
f9f68448
·
updated version number to 10.5
·
May 31, 2021
use_coordinate_systems
d116d04e
·
Use the coordinate system when handling the necessary transformations of the...
·
May 28, 2021
prefilter_phase
b5ef86d0
·
The prefilter preconditioner now sets the phase to the Bloch wavefunction...
·
May 27, 2021
lattice_split
8f78abea
·
Update test periodic_systems/18-TiO2.test.
·
May 20, 2021
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