Support Questions
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by: aharbilxaharbilx
23 Jun 2015 17:36
13 by shiferaw (guest)
08 Oct 2018 18:47 Jump!
"degenerate local-orbital radial functions" error for rgkmax=12. Calculations work well up to rgkmax=11. However deltaE between rgkmax=10 & 11 is ~0.8 mHartree. Is there a workaround to this error?
by: Nelson Rufus (guest)
24 Sep 2018 12:12
1  
by: yurivictyurivict
24 Sep 2018 00:24
1  
excitingmpi seems to be hanging upon completion of a GW computation
by: Levi keller (guest)
15 Mar 2018 14:12
4 by Yi Yao (guest)
21 Sep 2018 00:31 Jump!
Is there a problem with the new moke module?
by: ke yangke yang
05 Sep 2018 11:28
1  
The problem was solved. It was because of the supercomputer system that I've been using... How could I delete this thread? Thank you for the help!
by: Hwanhui YunHwanhui Yun
18 Jun 2018 18:52
3 by Hwanhui YunHwanhui Yun
24 Aug 2018 21:16 Jump!
Partial DOSs of equivalent atoms are different...
by: Hwanhui YunHwanhui Yun
24 Aug 2018 21:12
1  
How to calculate partial DOS
by: Hwanhui YunHwanhui Yun
21 Aug 2018 19:30
2 by Hwanhui YunHwanhui Yun
21 Aug 2018 19:37 Jump!
Doubt regarding the calculation of elastic constants for graphene from Energy vs Strain as implemented in exciting@elastic code. I followed the example provided in the link (http://exciting-code.org/lithium-energy-vs-strain-calculations).
by: daminingangdaminingang
21 Aug 2018 08:40
1  
hybrid calculation in tutorial_2018 example
by: sufyan_2018sufyan_2018
08 Aug 2018 15:22
1  
by: Alena Vishina (guest)
09 Jul 2018 16:29
2 by DmitriiNabokDmitriiNabok
01 Aug 2018 07:46 Jump!
Is it possible to calculate the contribution of the different polarizations (Longitudinal, transversal 1 transversal 2) to the phonon density of states using exciting?
by: Mercucio (guest)
28 Jul 2018 08:51
2 by PasqualePavonePasqualePavone
28 Jul 2018 12:47 Jump!
The program stops in GW cycle, seemingly because of a segmentation fault, but I can't find any reason for that
by: Thiago (guest)
25 Jul 2018 01:45
3 by Thiago (guest)
25 Jul 2018 19:58 Jump!
I am trying to plot PBE0 KS states using plot3d, but when I use a k point grid that is not 111 or 211, I get this error. This doesn't happen for LDA functionals.
by: Luning Zhao (guest)
05 Jul 2018 00:07
1  
Wrong degeneracy
by: mcjinyemcjinye
04 Jul 2018 18:08
1  
Can Exciting be used to calculate Second harmonic generation at different temperatures´╝č
by: pengfei (guest)
27 Jun 2018 10:54
2 by Dmitrii (guest)
27 Jun 2018 11:10 Jump!
When I run a calculation for symmetries in rhombohedral, monoclinic and triclinic gives an error that it's not implemented. Any comments on this please?
by: Manju (guest)
27 Jun 2018 06:12
1  
"a strong parallelization of the code"?
by: sahel loushabsahel loushab
09 Jun 2018 14:23
1  
I'm interested in EELS data from relatively large organic molecules (say 80 atoms)
by: Robert NRobert N
15 Jul 2013 23:45
16 by Sahel (guest)
09 Jun 2018 06:24 Jump!
Help me aboute Nanotube input file in ASE
by: A-hajimalekA-hajimalek
08 Jun 2018 11:51
1  
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