|
Positron Doppler calculation fails
|
|
5
|
310
|
March 30, 2023
|
|
No min/max C6 in for Van der Waals correction
|
|
0
|
140
|
March 22, 2023
|
|
Fail to run on MacOS catalina
|
|
2
|
234
|
March 21, 2023
|
|
EPH Task 11 netCDF error
|
|
10
|
353
|
March 13, 2023
|
|
Segfault when computing screening matrix
|
|
5
|
279
|
February 24, 2023
|
|
GW with kptrlatt
|
|
3
|
330
|
February 20, 2023
|
|
hBN phonons, no LO-TO splitting
|
|
3
|
412
|
February 10, 2023
|
|
Finite temperature
|
|
1
|
144
|
February 10, 2023
|
|
Error importing ``abilab`` - ``pymatgen ModuleNotFound Error``
|
|
2
|
689
|
February 7, 2023
|
|
DFPT + quasi-Fermi level method (occopt 9)
|
|
3
|
302
|
February 1, 2023
|
|
MPI IO error: ikpt_this_proc <=0
|
|
3
|
307
|
January 26, 2023
|
|
DMFT for spin polarization
|
|
3
|
238
|
February 1, 2023
|
|
OmegaMaxEnt: The imaginary time step can be either too small or too large
|
|
2
|
377
|
January 26, 2023
|
|
Geometry Optimization with External Force
|
|
3
|
190
|
January 24, 2023
|
|
EPH codes yield different results
|
|
4
|
283
|
January 18, 2023
|
|
How important is it to store 1WF files?
|
|
10
|
401
|
January 5, 2023
|
|
Extract data from _DOS file
|
|
1
|
192
|
January 5, 2023
|
|
Z2pack.surface.run
|
|
2
|
231
|
January 4, 2023
|
|
Generating PAW datasets and keeping the initial number of valence electrons for Doppler spectra calculation
|
|
1
|
174
|
December 14, 2022
|
|
Strange phonon dispersion fcc structure
|
|
1
|
326
|
December 6, 2022
|
|
MD NPT ensemble triggers BUG in symtk
|
|
0
|
179
|
December 1, 2022
|
|
Abinit k-point questions and abipy
|
|
3
|
425
|
December 1, 2022
|
|
Asymmetric Fermi window
|
|
1
|
154
|
November 28, 2022
|
|
DFT+U Calculation - Symmetry Error
|
|
1
|
205
|
November 20, 2022
|
|
Abinit terminated with signal 9 - ABINIT
|
|
0
|
279
|
November 12, 2022
|
|
Ti2B2 monolayer the result doesn't converge
|
|
3
|
319
|
October 22, 2022
|
|
Cif to abinit input file
|
|
0
|
338
|
October 18, 2022
|
|
SOC in AFM phase
|
|
2
|
262
|
October 18, 2022
|
|
Role of occopt in generating DOS and band structure
|
|
1
|
303
|
October 13, 2022
|
|
Full electron calculation for electron-positron annihilation
|
|
2
|
395
|
October 8, 2022
|