Latest Response calculations topics

Topic	Replies	Views	Activity
Moderators : Joao Abreu @joaocarloscabreu & Matthieu Verstraete @mverstra For information, the moderators of this category are Joao Abreu @joaocarloscabreu & Matthieu Verstraete @mverstra .	1	225	July 10, 2021
About the Response calculations category	0	249	January 13, 2021
Getshell: BUG - The calculated weights do not solve the linear system for all k-points	2	39	September 4, 2023
DFPT+U doesnt work for q != Gamma	6	141	August 29, 2023
Crash with PEAD NLO calculation	0	41	August 28, 2023
Crash while calculating non-linear optical response optic	8	52	August 17, 2023
Piezoelectric tensor	15	201	July 29, 2023
Non-linear susceptibility optic	0	63	July 28, 2023
Need lifetimes in electron-phonon tutorial for BoltzTraP2 code	0	73	July 19, 2023
ASR violation in AlAs fermi smearing	2	1177	July 13, 2021
Phonon energies in abinit output file are zero for all modes at all qpts, but energies in annaddb calculation from DDB file are normal	3	100	June 29, 2023
Large value of elastic constant c33	6	153	June 29, 2023
Static non-linear properties optic	1	121	June 27, 2023
Degeneracy problem in response calculation	3	105	June 16, 2023
Very low frequency optical response calculation	4	69	June 14, 2023
Pockels calculation using anaddb	0	139	May 23, 2023
Calculating the q resolved Eliashberg function	3	164	May 2, 2023
Phonon frequencies change with nband for insulating	1	157	April 11, 2023
EPH Task 11 netCDF error parallelism	10	212	March 13, 2023
hBN phonons, no LO-TO splitting	3	223	February 10, 2023
DFPT + quasi-Fermi level method (occopt 9)	3	161	February 1, 2023
EPH codes yield different results	4	157	January 18, 2023
How important is it to store 1WF files?	10	288	January 5, 2023
Strange phonon dispersion fcc structure	1	213	December 6, 2022
Asymmetric Fermi window	1	119	November 28, 2022
Error parallelizing DFPT calculation parallelism	3	252	August 15, 2022
Potential residual convergence in bilayer MoS2	7	621	June 18, 2022
Calculated structure electron density (PAW) compilation , parallelism	1	315	June 2, 2022
Abinit and anaddb dielectric tensor and effective charges outputs incoherences	5	455	May 19, 2022
Asked to delete not existent file: <filename>.abo_PRT1	3	269	May 16, 2022