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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

2245 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

2501 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

2972 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

5597 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

3358 Views

Last post by fme3535
Mon Feb 03, 2014 5:11 pm
Issue with VASP TaskServers - Jobs not added in queue automatically

Last post by admin « Mon Feb 03, 2014 3:31 pm
Replies: 1
by dmmgiisc » Mon Feb 03, 2014 10:06 am

1 Replies

2711 Views

Last post by admin
Mon Feb 03, 2014 3:31 pm
VERY BAD NEWS! internal error in subroutineMKDMAT:

Last post by alex « Mon Feb 03, 2014 10:28 am
Replies: 1
by dekoning » Wed May 20, 2009 1:48 pm

1 Replies

3094 Views

Last post by alex
Mon Feb 03, 2014 10:28 am
Error EDDDAV: Call to ZHEGV failed on Ivy Bridge Xeon

Last post by paulfons « Thu Jan 30, 2014 7:30 am
Replies: 1
by paulfons » Thu Jan 30, 2014 6:06 am

1 Replies

8014 Views

Last post by paulfons
Thu Jan 30, 2014 7:30 am
Frequency calculation with ibrion=5

Last post by Ghorbanpour « Wed Jan 29, 2014 2:29 am
Replies: 2
by Ghorbanpour » Mon Jan 06, 2014 6:36 am

2 Replies

3842 Views

Last post by Ghorbanpour
Wed Jan 29, 2014 2:29 am
Gap in pristine graphene DOS

Last post by Lian « Thu Jan 23, 2014 4:46 pm
Replies: 2
by Lian » Tue Jan 14, 2014 7:24 pm

2 Replies

3727 Views

Last post by Lian
Thu Jan 23, 2014 4:46 pm
Spin polarised LOPTICS calculations

Last post by VaspPeer « Tue Jan 21, 2014 5:10 pm
Replies: 1
by VaspPeer » Tue Jan 14, 2014 4:23 pm

1 Replies

2668 Views

Last post by VaspPeer
Tue Jan 21, 2014 5:10 pm
VASP linear response problem keeps failing. Out of memory?

Last post by salina « Sat Jan 18, 2014 2:38 pm
Replies: 6
by bakkedal » Sat Nov 09, 2013 5:55 pm

6 Replies

6456 Views

Last post by salina
Sat Jan 18, 2014 2:38 pm
Diverged energy during DFPT calculation.

Last post by abalone « Wed Jan 15, 2014 3:00 pm
Replies: 1
by abalone » Sun Jan 12, 2014 3:04 pm

1 Replies

2901 Views

Last post by abalone
Wed Jan 15, 2014 3:00 pm
absence of f-electrons in Sm_3 PAW-PBE potential

Last post by psghosh « Wed Jan 15, 2014 11:56 am
Replies: 2
by psghosh » Wed Jan 15, 2014 11:37 am

2 Replies

3729 Views

Last post by psghosh
Wed Jan 15, 2014 11:56 am
VASP/WANNIER90 interface out of date

Last post by leoant « Thu Jan 09, 2014 9:34 pm
Replies: 4
by myliu » Sun Oct 27, 2013 4:48 pm

4 Replies

10736 Views

Last post by leoant
Thu Jan 09, 2014 9:34 pm
Problems with vdW-DFT

Last post by brockp « Tue Jan 07, 2014 10:29 pm
Replies: 8
by jmorale4 » Wed Feb 06, 2013 3:58 am

8 Replies

8528 Views

Last post by brockp
Tue Jan 07, 2014 10:29 pm
local QP operation err

Last post by kuang « Wed Dec 11, 2013 11:02 pm
Replies: 2
by kuang » Mon Dec 09, 2013 4:36 pm

2 Replies

4494 Views

Last post by kuang
Wed Dec 11, 2013 11:02 pm
Error message when runing VASP on more than one node

Last post by sxy « Mon Dec 09, 2013 3:57 am
Replies: 9
by berni_k86 » Tue Feb 19, 2013 3:32 pm

9 Replies

9752 Views

Last post by sxy
Mon Dec 09, 2013 3:57 am
Hybrid functional calculation - segmentation fault

Last post by VBolnykh « Sun Dec 08, 2013 7:56 pm
Replies: 1
by VBolnykh » Sun Dec 08, 2013 10:25 am

1 Replies

2531 Views

Last post by VBolnykh
Sun Dec 08, 2013 7:56 pm
non-collinear: "LAPACK: Routine ZPOTRF failed!"

Last post by WJoost « Sun Dec 01, 2013 8:12 pm
Replies: 9
by lahaye » Fri Nov 24, 2006 11:50 pm

9 Replies

19392 Views

Last post by WJoost
Sun Dec 01, 2013 8:12 pm

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