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Incorrect energy in calculation w/ spin-orbit (vasp.4.6.28)

Last post by Modey3 « Mon Feb 16, 2009 11:05 pm
Replies: 3
by user » Mon Jan 16, 2006 2:30 am

3 Replies

9514 Views

Last post by Modey3
Mon Feb 16, 2009 11:05 pm
MPI_BLOCK

Last post by job « Sat Feb 14, 2009 8:09 am
Replies: 1
by martonak » Fri Feb 13, 2009 10:03 am

1 Replies

7401 Views

Last post by job
Sat Feb 14, 2009 8:09 am
Symmetry is not imposed on AECCAR density

Last post by admin « Mon Feb 09, 2009 1:48 pm
Replies: 1
by ssharifz » Wed Dec 17, 2008 9:59 pm

1 Replies

6382 Views

Last post by admin
Mon Feb 09, 2009 1:48 pm
ERROR FEXCF

Last post by admin « Mon Feb 09, 2009 1:36 pm
Replies: 2
by lusommmg » Sun Apr 27, 2008 12:46 pm

2 Replies

11346 Views

Last post by admin
Mon Feb 09, 2009 1:36 pm
LAPACK: Routine ZPOTRF failed! 1

Last post by admin « Mon Feb 09, 2009 1:23 pm
Replies: 1
by snoopjd » Sun Feb 08, 2009 2:17 pm

1 Replies

10105 Views

Last post by admin
Mon Feb 09, 2009 1:23 pm
LAPACK: Routine ZPOTRF failed

Last post by admin « Thu Feb 05, 2009 3:17 pm
Replies: 5
by okuno » Tue Oct 28, 2008 5:55 am

5 Replies

33969 Views

Last post by admin
Thu Feb 05, 2009 3:17 pm
Standard LSF/VASP error when requesting more than 1 node

Last post by admin « Mon Feb 02, 2009 1:14 pm
Replies: 1
by snoopjd » Thu Jan 29, 2009 6:17 pm

1 Replies

7721 Views

Last post by admin
Mon Feb 02, 2009 1:14 pm
ERROR：FEXCF

Last post by admin « Thu Jan 08, 2009 1:15 pm
Replies: 1
by fegg7502 » Fri Dec 26, 2008 1:28 am

1 Replies

7136 Views

Last post by admin
Thu Jan 08, 2009 1:15 pm
What's means....error: Exit with code 139....line 8: segmentation fault??

Last post by admin « Fri Dec 05, 2008 3:32 pm
Replies: 1
by sebasdux » Mon Dec 01, 2008 1:50 pm

1 Replies

7919 Views

Last post by admin
Fri Dec 05, 2008 3:32 pm
energy mismatch on continuation run

Last post by admin « Thu Nov 27, 2008 2:28 pm
Replies: 1
by jinhua » Wed Nov 26, 2008 9:08 pm

1 Replies

6413 Views

Last post by admin
Thu Nov 27, 2008 2:28 pm
WARNING: Sub-Space-Matrix is not hermitian in DAV

Last post by admin « Wed Nov 26, 2008 9:56 am
Replies: 1
by Borninger » Mon Nov 24, 2008 12:18 pm

1 Replies

9188 Views

Last post by admin
Wed Nov 26, 2008 9:56 am
hydrogen not detcted during calculation

Last post by ag9xc « Wed Nov 19, 2008 4:26 pm
Replies: 2
by ag9xc » Wed Nov 19, 2008 3:31 pm

2 Replies

7080 Views

Last post by ag9xc
Wed Nov 19, 2008 4:26 pm
Race condition issue in large-scale parallel jobs?

Last post by d-farrell2 « Mon Nov 17, 2008 2:51 pm
Replies: 1
by d-farrell2 » Fri Nov 14, 2008 6:15 pm

1 Replies

5913 Views

Last post by d-farrell2
Mon Nov 17, 2008 2:51 pm
basis set compleness

Last post by admin « Tue Nov 11, 2008 4:26 pm
Replies: 1
by wahyu » Fri Oct 24, 2008 5:57 pm

1 Replies

6376 Views

Last post by admin
Tue Nov 11, 2008 4:26 pm
"fatal internal in brackting system-shutdown; contact gK immediately"

Last post by camilo « Sun Oct 26, 2008 8:29 pm
Replies: 1
by pang_qing » Fri Oct 24, 2008 2:14 pm

1 Replies

8844 Views

Last post by camilo
Sun Oct 26, 2008 8:29 pm
The "informationâ€� in the MD caculations

Last post by admin « Thu Oct 23, 2008 12:28 pm
Replies: 1
by fegg7502 » Thu Oct 23, 2008 1:35 am

1 Replies

7725 Views

Last post by admin
Thu Oct 23, 2008 12:28 pm
The problem in MD calculation

Last post by admin « Thu Oct 23, 2008 10:23 am
Replies: 1
by fegg7502 » Thu Oct 23, 2008 1:50 am

1 Replies

6413 Views

Last post by admin
Thu Oct 23, 2008 10:23 am
How to display more significant figures in OUTCAR

Last post by admin « Wed Oct 08, 2008 12:15 pm
Replies: 1
by gpkmohan » Wed Oct 08, 2008 10:22 am

1 Replies

7119 Views

Last post by admin
Wed Oct 08, 2008 12:15 pm
Fatal Internal in Bracketing

Last post by gpkmohan « Wed Oct 08, 2008 10:28 am
Replies: 5
by sudhakar » Thu Feb 23, 2006 2:05 pm

5 Replies

24330 Views

Last post by gpkmohan
Wed Oct 08, 2008 10:28 am
How to calculate 4f DOS ?

Last post by nany « Wed Oct 01, 2008 11:05 am
Replies: 3
by shihongting » Tue Apr 08, 2008 10:09 am

3 Replies

10992 Views

Last post by nany
Wed Oct 01, 2008 11:05 am

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