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combined_xc_derivatives
cd0f9f73
·
further debuggin attempt
·
Jan 15, 2020
fxc-gga
c6d885d5
·
minor fix
·
Jan 07, 2020
fix_mesh_precision_issue
a69dedbc
·
Fix finite precision bug
·
Dec 05, 2019
singularity_coulomb_integrals
ee67e37a
·
Merge branch 'develop' into singularity_coulomb_integrals
·
Dec 05, 2019
pcm_substrate
77fdc87f
·
Merging by hand PCM matrix readout external file as implemented by Alain...
·
Nov 26, 2019
minor_fix_batches
fda725b9
·
Minor fixes related to the use of batches. This reduces a bit the number of...
·
Nov 21, 2019
td_pcm
f7f2001d
·
Minor fix-up to the conditions for printing out the PCM polarization charges due to electrons.
·
Nov 18, 2019
cuda_aware_mpi_fix_types
7088bbeb
·
Merge remote-tracking branch 'origin/fix_types' into cuda_aware_mpi_fix_types
·
Nov 08, 2019
ion_current_gauge_field
93af1c88
·
Corrected the timing of the force for the gauge field.
·
Aug 29, 2019
fix_U_J_ACBN0
516431a3
·
Merging with develop.
·
Jul 14, 2019
floquet_merge
cb3d2adc
·
fixed spinors after merge
·
Jun 24, 2019
fix_states_paral_look_and_load
0633f849
·
Fix the routine states_look_and_load to support the states parallelization. This is not yet tested.
·
May 20, 2019
pulpito
501e3e23
·
Removed some unnecessary code from epot.
·
Feb 09, 2019
combined_dotp_gemv
4b768d11
·
Adding a routine for doing multiple dot products at once, using Blas 2 GEMV routine when possible.
·
Feb 09, 2019
heat_current
e6ccc297
·
added heat conductivity to conductivity util
·
Jan 16, 2019
pseudo_para_current
b865d23e
·
As we are adding the contribution from the nonlocal operator, we must have the...
·
Nov 22, 2018
improve_description
fc4bde09
·
Improve the description of the variable DoubeFFTParameter.
·
Nov 21, 2018
PTG_exp
286a756e
·
Trial implementation of the PTG for the exponential apply method.
·
Nov 05, 2018
ptg
29e75a89
·
Quick and dirty first implementation of the parallel transport gauge
·
Nov 02, 2018
test_new_preconditioners
f6cb604a
·
add two preconditioners: energy and double_jacobi
·
Oct 31, 2018
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