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VASP using MPI libraries

Last post by admin « Wed Sep 27, 2006 9:28 am
Replies: 1
by nitin_jadon » Wed Sep 27, 2006 6:23 am

1 Replies

9373 Views

Last post by admin
Wed Sep 27, 2006 9:28 am
Charged System (Proton)

Last post by cpp6f « Sat Sep 23, 2006 2:14 am
Replies: 1
by srcalvo » Fri Sep 22, 2006 11:21 pm

1 Replies

9519 Views

Last post by cpp6f
Sat Sep 23, 2006 2:14 am
Uranium POTPAW

Last post by cdt9f « Fri Sep 22, 2006 1:46 pm
Replies: 1
by cdt9f » Tue Sep 19, 2006 6:43 pm

1 Replies

10575 Views

Last post by cdt9f
Fri Sep 22, 2006 1:46 pm
problems running with Debian3, kernel 2.4

Last post by admin « Thu Sep 21, 2006 2:27 pm

by admin » Thu Sep 21, 2006 2:27 pm

0 Replies

7711 Views

Last post by admin
Thu Sep 21, 2006 2:27 pm
technical question: how to write CHGCAR more often?

Last post by hra « Tue Sep 19, 2006 8:06 pm
Replies: 2
by hra » Thu Sep 14, 2006 11:15 pm

2 Replies

13114 Views

Last post by hra
Tue Sep 19, 2006 8:06 pm
segmentation fault after 5 iterations

Last post by admin « Tue Sep 19, 2006 12:52 pm
Replies: 2
by PÃ¤r Olsson » Wed Feb 16, 2005 9:52 am

2 Replies

19215 Views

Last post by admin
Tue Sep 19, 2006 12:52 pm
Wierd Automatically generated KPOINT

Last post by admin « Mon Sep 18, 2006 2:21 pm
Replies: 1
by darby » Thu Sep 14, 2006 10:21 pm

1 Replies

9841 Views

Last post by admin
Mon Sep 18, 2006 2:21 pm
force not converged

Last post by admin « Wed Sep 13, 2006 10:02 am
Replies: 1
by menguo » Mon Sep 11, 2006 10:23 pm

1 Replies

9754 Views

Last post by admin
Wed Sep 13, 2006 10:02 am
internal ERROR SETYLM: -9, 14, 50, 5, -10, 2*13 internal ERROR SETYLM

Last post by sridevi « Mon Sep 11, 2006 8:38 pm
Replies: 2
by sridevi » Tue Sep 05, 2006 6:56 pm

2 Replies

16217 Views

Last post by sridevi
Mon Sep 11, 2006 8:38 pm
partial DOS & PROCAR WARNING

Last post by admin « Wed Sep 06, 2006 8:23 am
Replies: 1
by lahaye » Fri Aug 25, 2006 8:02 am

1 Replies

12552 Views

Last post by admin
Wed Sep 06, 2006 8:23 am
bug in calculation of E%PSCENC

Last post by cpp6f « Fri Aug 04, 2006 7:00 pm
Replies: 2
by cpp6f » Mon Jul 24, 2006 10:04 pm

2 Replies

14480 Views

Last post by cpp6f
Fri Aug 04, 2006 7:00 pm
minor bug in rmm-diis.F

Last post by admin « Fri Aug 04, 2006 11:55 am
Replies: 1
by cpp6f » Fri Jul 28, 2006 1:59 am

1 Replies

9624 Views

Last post by admin
Fri Aug 04, 2006 11:55 am
too many electronic iterations

Last post by bandy « Wed Aug 02, 2006 6:33 am
Replies: 1
by Charles W. Bauschlicher » Fri Jul 28, 2006 8:27 pm

1 Replies

10162 Views

Last post by bandy
Wed Aug 02, 2006 6:33 am
pseudopotential strength

Last post by admin « Tue Aug 01, 2006 12:34 pm
Replies: 1
by jaburt » Tue Jul 18, 2006 8:09 pm

1 Replies

11178 Views

Last post by admin
Tue Aug 01, 2006 12:34 pm
POTCAR error

Last post by admin « Mon Jul 17, 2006 11:59 am
Replies: 1
by srcalvo » Fri Jul 14, 2006 3:27 pm

1 Replies

12125 Views

Last post by admin
Mon Jul 17, 2006 11:59 am
"hit a member that was already found in another star" ?

Last post by admin « Tue Jul 11, 2006 9:44 am
Replies: 4
by lahaye » Mon Jul 10, 2006 7:15 am

4 Replies

18545 Views

Last post by admin
Tue Jul 11, 2006 9:44 am
reading WAVECAR when number of k-points has changed

Last post by admin « Thu Jun 29, 2006 1:36 pm
Replies: 1
by cpp6f » Thu Jun 29, 2006 3:31 am

1 Replies

12221 Views

Last post by admin
Thu Jun 29, 2006 1:36 pm
Another SGE question about submitting VASP jobs

Last post by tjf « Fri Jun 16, 2006 8:46 am
Replies: 1
by hwang4 » Thu Jun 15, 2006 8:22 pm

1 Replies

10708 Views

Last post by tjf
Fri Jun 16, 2006 8:46 am
Segmentation Fault

Last post by admin « Tue Jun 13, 2006 7:36 am

by admin » Tue Jun 13, 2006 7:36 am

0 Replies

10549 Views

Last post by admin
Tue Jun 13, 2006 7:36 am
How to prevent SGE from assigning more nodes than I actually want for my VASP calculations?

Last post by hwang4 « Fri Jun 09, 2006 2:18 pm
Replies: 2
by hwang4 » Fri Jun 09, 2006 2:06 am

2 Replies

11016 Views

Last post by hwang4
Fri Jun 09, 2006 2:18 pm

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