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GW0 band gap results different between 5.3.3 and earlier versions

Last post by huangj3 « Fri Apr 25, 2014 5:19 pm
Replies: 3
by huangj3 » Thu Feb 21, 2013 12:15 am

3 Replies

6650 Views

Last post by huangj3
Fri Apr 25, 2014 5:19 pm
Fermi level is 0.5 eV difference in SC and non-SC calculations

Last post by admin « Thu Apr 24, 2014 3:37 pm
Replies: 1
by bioggg » Mon Apr 21, 2014 6:36 pm

1 Replies

4991 Views

Last post by admin
Thu Apr 24, 2014 3:37 pm
Strange Memory Usage Problem

Last post by admin « Tue Apr 22, 2014 8:38 am
Replies: 1
by paulfons » Tue Apr 15, 2014 1:21 am

1 Replies

7857 Views

Last post by admin
Tue Apr 22, 2014 8:38 am
wannier90.* not generated

Last post by burbanom « Thu Apr 17, 2014 5:29 am
Replies: 1
by robinchm » Mon Apr 14, 2014 6:38 am

1 Replies

5248 Views

Last post by burbanom
Thu Apr 17, 2014 5:29 am
Problem in charge.f at line 1365?

Last post by cchang « Mon Mar 31, 2014 9:27 pm
Replies: 2
by jn_petersen » Fri Apr 05, 2013 3:43 am

2 Replies

5985 Views

Last post by cchang
Mon Mar 31, 2014 9:27 pm
VASP error on Na-O compound calculations (ERROR FEXCF: supplied exchange-correlation table is too..)

Last post by gmodegar « Wed Mar 26, 2014 3:53 pm
Replies: 3
by fcrhkdans » Tue Mar 26, 2013 7:35 pm

3 Replies

12952 Views

Last post by gmodegar
Wed Mar 26, 2014 3:53 pm
memory corruption

Last post by alex « Mon Mar 24, 2014 7:54 am
Replies: 2
by ppphysics » Thu May 09, 2013 5:43 pm

2 Replies

6786 Views

Last post by alex
Mon Mar 24, 2014 7:54 am
NEB fails! Calculation seems to run only on the first image!

Last post by kambiz « Mon Mar 17, 2014 8:28 am
Replies: 2
by spoudyal » Thu Feb 20, 2014 10:50 pm

2 Replies

5685 Views

Last post by kambiz
Mon Mar 17, 2014 8:28 am
NPAR error in DOS calculation

Last post by Yue-Wen Fang « Thu Mar 13, 2014 12:28 pm
Replies: 8
by ccccc » Mon Nov 11, 2013 7:06 pm

8 Replies

11990 Views

Last post by Yue-Wen Fang
Thu Mar 13, 2014 12:28 pm
error while running with LWANNIER90=.TRUE.

Last post by karlzhou87 « Thu Mar 13, 2014 9:20 am
Replies: 6
by miruto » Mon Jul 30, 2012 6:28 pm

6 Replies

16836 Views

Last post by karlzhou87
Thu Mar 13, 2014 9:20 am
Total memory used by the VASP calculation

Last post by admin « Tue Mar 11, 2014 1:43 pm
Replies: 1
by deepashri » Thu Feb 27, 2014 10:33 am

1 Replies

5838 Views

Last post by admin
Tue Mar 11, 2014 1:43 pm
Differrent Fermi levels with different k-paths

Last post by admin « Tue Mar 11, 2014 1:23 pm
Replies: 1
by Lian » Mon Mar 03, 2014 6:12 pm

1 Replies

5143 Views

Last post by admin
Tue Mar 11, 2014 1:23 pm
Problems in lanthanoid with 4f electrons in the valence

Last post by admin « Tue Mar 04, 2014 10:54 am
Replies: 1
by mamoru_sakaue » Tue Mar 04, 2014 10:01 am

1 Replies

8409 Views

Last post by admin
Tue Mar 04, 2014 10:54 am
About "ERROR FEXCP: supplied Exchange-correletion table is too small"

Last post by freshwind « Fri Feb 14, 2014 4:31 pm
Replies: 8
by ichthyornis » Thu Oct 13, 2005 5:23 am

8 Replies

49016 Views

Last post by freshwind
Fri Feb 14, 2014 4:31 pm
internal ERROR 2 in WDES_SET_NPRO: 1505632114 219

Last post by admin « Fri Feb 14, 2014 11:20 am
Replies: 1
by freshwind » Thu Jan 23, 2014 10:37 pm

1 Replies

4896 Views

Last post by admin
Fri Feb 14, 2014 11:20 am
Problem in understanding DOS [Patial DOS case]

Last post by admin « Fri Feb 14, 2014 11:14 am
Replies: 1
by Khaqan Shati » Wed Jan 22, 2014 9:03 am

1 Replies

4559 Views

Last post by admin
Fri Feb 14, 2014 11:14 am
problem on Sm potential

Last post by admin « Tue Feb 04, 2014 6:27 pm
Replies: 1
by wen » Sun Jan 19, 2014 8:46 am

1 Replies

4671 Views

Last post by admin
Tue Feb 04, 2014 6:27 pm
No Electronic Convergence for In_d PAW PBE dataset

Last post by admin « Tue Feb 04, 2014 6:22 pm
Replies: 1
by skasiraj » Wed Jan 22, 2014 8:43 am

1 Replies

5412 Views

Last post by admin
Tue Feb 04, 2014 6:22 pm
HSE03 stops. Gradient not orthogonal

Last post by hipertrofia « Tue Feb 04, 2014 3:05 pm
Replies: 2
by sponza » Wed Dec 04, 2013 5:24 pm

2 Replies

8878 Views

Last post by hipertrofia
Tue Feb 04, 2014 3:05 pm
NaN in self-consistent GW calculation

Last post by fme3535 « Mon Feb 03, 2014 5:11 pm
Replies: 1
by biklooost » Mon May 20, 2013 8:27 pm

1 Replies

5959 Views

Last post by fme3535
Mon Feb 03, 2014 5:11 pm

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