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Shiftk not fully printed out in output file
|
|
2
|
124
|
June 12, 2023
|
|
Restart from previous DFPT calculations
|
|
1
|
159
|
November 14, 2023
|
|
Bader analysis abinit 9.6.2 - files-file problem
|
|
8
|
75
|
April 23, 2024
|
|
2024 ABINIT school 29 January - 2 February
|
|
0
|
193
|
October 25, 2023
|
|
Not getting degenrate m-resolved DOS for t2g and eg orbitals of SrVO3 in real spherical harmonic basis
|
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5
|
100
|
April 1, 2024
|
|
Band structure calculation using Hybrid Functionals
|
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0
|
182
|
September 26, 2023
|
|
Crash with DFPT chi2 calculation
|
|
1
|
123
|
September 25, 2023
|
|
Resuming calculation after stopping
|
|
1
|
132
|
March 18, 2024
|
|
Effect of time-reversal symmetry on SCF convergence
|
|
1
|
145
|
June 28, 2023
|
|
Abinit interface to Wannier90 code for spinor wave functions
|
|
4
|
88
|
May 1, 2024
|
|
Phonon eigenvectors at just one q-point
|
|
1
|
115
|
December 10, 2023
|
|
Need lifetimes in electron-phonon tutorial for BoltzTraP2 code
|
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0
|
177
|
July 19, 2023
|
|
Hostfile to run abinit mpirun -np 32 -hostfile hosts ./abinit
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|
1
|
115
|
October 10, 2023
|
|
PAW calculation in EPH
|
|
2
|
90
|
January 22, 2024
|
|
DFTP NLO tutorial broken
|
|
1
|
116
|
November 5, 2023
|
|
Usecprj=0 : BUG in init_plowannier
|
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1
|
132
|
June 3, 2023
|
|
How to interpret the warning "does not exist but found netcdf file with similar name."
|
|
1
|
96
|
October 6, 2023
|
|
Non-linear susceptibility
|
|
0
|
148
|
July 28, 2023
|
|
Inconsistency in total energy with 2D cutoff
|
|
1
|
101
|
October 24, 2023
|
|
ABINIT v9.10.1 production release
|
|
0
|
190
|
June 27, 2023
|
|
Abipy workdir-error
|
|
4
|
88
|
February 27, 2024
|
|
Paral_kgb 1 not working with bands / plane-waves
|
|
3
|
76
|
March 22, 2024
|
|
2024 ABINIT school 29 January - 2 February 2024 : a reminder - deadline approaching!
|
|
0
|
138
|
November 24, 2023
|
|
Hybrids-Defects & coulomb cuttoff
|
|
0
|
133
|
September 20, 2023
|
|
Crash with PEAD NLO calculation
|
|
0
|
123
|
August 28, 2023
|
|
Convergence problems Two-Component DFT
|
|
1
|
69
|
April 19, 2024
|
|
Missing file: scfo_DS3_1WF36
|
|
0
|
105
|
November 16, 2023
|
|
Abinit getting stuck at 1st iteration
|
|
4
|
46
|
April 1, 2024
|
|
K-points for (111) surface BZ
|
|
2
|
44
|
April 24, 2024
|
|
ONCVPSP for Uranium? Xe.hpc.paw, Kr.hpc.paw?
|
|
0
|
81
|
December 21, 2023
|
|
Question about default parameters
|
|
0
|
79
|
September 26, 2023
|
|
Install abinit via home-brew
|
|
3
|
40
|
May 15, 2024
|
|
Visualizing spin dynamics from .nc (NetCDF) files generated by multibinit
|
|
0
|
78
|
October 3, 2023
|
|
Wannier functions for cRPA & DMFT with several correlated sites in unit-cell
|
|
1
|
56
|
April 16, 2024
|
|
Optic response calculation failing for higher ngkpt
|
|
2
|
38
|
April 25, 2024
|
|
Error in the calculation of quadrupole tensor
|
|
0
|
61
|
March 20, 2024
|
|
Decomposition of magnetization in mixalch calculation
|
|
1
|
43
|
April 9, 2024
|
|
Spgroup 151 not respecting Wyckoff multiplicity
|
|
1
|
21
|
May 17, 2024
|