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Wannier90 does not reproduce DFT bands
|
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10
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382
|
July 1, 2023
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Problem encountered while calculating spectral function (DMFT) using OmegaMaxEnt
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12
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290
|
May 24, 2023
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NLO tutorial broken
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16
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183
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October 3, 2023
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Parallel fallbacks Netcdf
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19
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172
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March 18, 2024
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Combine triqs with abinit
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11
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247
|
July 13, 2023
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DFPT+U doesnt work for q != Gamma
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11
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253
|
April 18, 2024
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Parallel hdf5 and netcdf
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12
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176
|
October 11, 2023
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Crash while calculating non-linear optical response
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9
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174
|
October 4, 2023
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Choosing appropriate number of Matsubara frequency for spectral function
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10
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218
|
July 24, 2023
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_OPT file is not generated for conducti
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13
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195
|
July 13, 2023
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Multibinit spin dynamics does not run in parallel on more than 1 CPU cores
|
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11
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132
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October 3, 2023
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Ctqmc_setSweeps : sweeps is negative or too big
|
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9
|
110
|
July 29, 2023
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Issues with Relaxing a Ni(119) Slab
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10
|
72
|
March 13, 2024
|
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Reference netiquette for the discourse abinit forum
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0
|
85
|
November 5, 2023
|
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Large value of elastic constant c33
|
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6
|
246
|
June 29, 2023
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Question on Wannier90 get_projections when SOC is taken into account
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5
|
316
|
March 9, 2024
|
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HDF library specification
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7
|
198
|
October 3, 2023
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Brew install abinit
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5
|
275
|
May 26, 2023
|
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Wannier90 band structure calculation taking too long
|
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6
|
201
|
June 29, 2023
|
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DFPT_CGWF WARNING : d2edt2 is zero, skipping update
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4
|
247
|
July 29, 2023
|
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DFPT calculations , wave-functions dont converge
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6
|
183
|
November 12, 2023
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Tutorial v9-t44 can not run correct
|
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7
|
197
|
July 2, 2023
|
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How do I get the same orientation of the lattice?
|
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6
|
233
|
July 24, 2023
|
|
ABINIT v9.10.5 production release
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0
|
64
|
February 22, 2024
|
|
Kpt boundaries for cubic supercell
|
|
3
|
330
|
October 11, 2023
|
|
Electron density of the Kohn-Sham states at specific k-points in the band structure
|
|
4
|
216
|
July 17, 2023
|
|
Fatbands using norm-conserving pseudopotential
|
|
4
|
227
|
May 31, 2023
|
|
Printing WFK file for some bands only
|
|
1
|
144
|
May 8, 2023
|
|
Finite difference non-linear susceptibility gives zero
|
|
3
|
155
|
September 25, 2023
|
|
Spack install abinit
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|
2
|
183
|
December 5, 2023
|
|
Partial charge density
|
|
2
|
192
|
May 23, 2023
|
|
Question regarding DMFT tutorial on SrVO3
|
|
5
|
162
|
July 12, 2023
|
|
Very low frequency optical response calculation
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|
4
|
139
|
June 14, 2023
|
|
Quasi Fermi level keeps crashing - Occopt 9
|
|
2
|
176
|
May 22, 2023
|
|
Nonlinear susceptibility calculated by HSE06
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|
2
|
174
|
August 13, 2023
|
|
Degeneracy problem in response calculation
|
|
3
|
157
|
June 16, 2023
|
|
Static non-linear properties
|
|
1
|
229
|
June 27, 2023
|
|
Memory problem in positron Doppler broadening calculation
|
|
2
|
207
|
July 23, 2023
|
|
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
|
160
|
June 29, 2023
|
|
How to obtain the standard input structure for Abinit
|
|
1
|
197
|
July 6, 2023
|
|
ABINIT v10.0.3 production release
|
|
0
|
35
|
April 15, 2024
|
|
Something wrong in plotting
|
|
3
|
125
|
May 10, 2023
|
|
Constrained relaxation, relax layers rigidly
|
|
2
|
147
|
August 19, 2023
|
|
'mode effective charge' in anaddb post-processing routine
|
|
2
|
167
|
May 9, 2023
|
|
Charge density calculation fails using prtden 4
|
|
2
|
141
|
May 8, 2023
|
|
K-points problem in cRPA
|
|
1
|
174
|
June 1, 2023
|
|
Large deviations in single-atom total energy calculations
|
|
3
|
107
|
November 10, 2023
|
|
Temperature-dependent Fermi level in EPH code
|
|
4
|
94
|
November 7, 2023
|
|
The paw pseudopotential calculation for nonlinear properties does not converge
|
|
1
|
210
|
July 20, 2023
|
|
Crash while performing positron calculation with larger vacancy
|
|
2
|
147
|
August 19, 2023
|