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update_spgl1
1604c601
·
Further minor changes to the BPDN implementation
·
Jan 14, 2025
pseudodojo_fr_pbe
a3ad6909
·
Fix a problem in which d orbitals have less projectors than p (O, F, Z=89, and Z=80).
·
Jan 14, 2025
default_chebyshev_par_states
2437cca5
·
Updating test files and tolerances.
·
Jan 14, 2025
quantities_list
8ce890a7
·
changed quantity label to fixed length to address compiler warnings
·
Jan 14, 2025
fix_verrou_3
b56c3ee2
·
Update the reference values.
·
Jan 14, 2025
phase_bessel
b8b7f018
·
Add input option to control whether the A^2 term is included or not
·
Jan 14, 2025
main
default
protected
f56f3aae
·
Merge branch 'break_target_module' into 'main'
·
Jan 14, 2025
ace_default
672b1183
·
Adjust some tolerances.
·
Jan 14, 2025
isdf/kmeans_app_test
71efdb9b
·
Remove the unnecessary extra pseudopotential.
·
Jan 13, 2025
ci-update-presets
02e6296b
·
Move to a single tolerance for equivalent physical quantities, defined...
·
Jan 13, 2025
ldos_output
e4c05922
·
Adds the LDOS as output.
·
Jan 13, 2025
restructure_ks_potentials
c63823ad
·
Major refactoring of the xc code
·
Jan 13, 2025
elpa
c33bcd95
·
Refactor FindELPA.cmake again
·
Jan 13, 2025
change_default_exp_method
a582b267
·
Updating reference values
·
Jan 13, 2025
remove_io_assign
ed27d406
·
Remove io_assign
·
Jan 10, 2025
activate_gpu_test
01b10153
·
Automatic update of test values from testsuite app
·
Jan 10, 2025
use_f08_functions
eddb1a97
·
Use some more Fortran2008 intrinsic math functions
·
Jan 10, 2025
ci-cmake-intel-mpi
3c4d3465
·
Revert -warn unused for intel classic
·
Jan 10, 2025
722-add-charge-density-and-scalar-potential-as-interactions
bbea46de
·
Update test after rebase
·
Jan 09, 2025
test_reverting_hgh_filtering
2f9d2e0b
·
revert removal of PS filter for HGH
·
Jan 09, 2025
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