Bug reports

Moderators: Global Moderator, Moderator

New Topic

1424 topics

Page 48 of 72
- Jump to page:
Previous
1
…
46
47
48
49
50
…
72
Next

Topics

Replies

Views

Last post

Energy increasing during geometry relaxation

Last post by jcconesa « Thu Jun 14, 2012 11:39 pm
Replies: 2
by jcconesa » Wed Jun 13, 2012 7:21 pm

2 Replies

2838 Views

Last post by jcconesa
Thu Jun 14, 2012 11:39 pm
'Selective dynamics' problem

Last post by b-jour « Mon Jun 11, 2012 10:41 pm
Replies: 10
by b-jour » Mon Jun 04, 2012 1:33 pm

10 Replies

5772 Views

Last post by b-jour
Mon Jun 11, 2012 10:41 pm
Different NBANDS value from two computer resources

Last post by gevolo « Sun Jun 10, 2012 4:33 pm
Replies: 5
by pnita » Wed Apr 25, 2012 9:09 pm

5 Replies

3769 Views

Last post by gevolo
Sun Jun 10, 2012 4:33 pm
Hybrid functionals and OPTIC file in VASP5

Last post by jjhskang « Fri May 25, 2012 1:08 am
Replies: 2
by mf081 » Wed Aug 05, 2009 11:43 am

2 Replies

3177 Views

Last post by jjhskang
Fri May 25, 2012 1:08 am
Periodic replication of orbitals from CHGCAR - Is it possible?

Last post by olson139 « Wed May 09, 2012 12:52 am
Replies: 2
by olson139 » Thu Mar 22, 2012 9:35 pm

2 Replies

2492 Views

Last post by olson139
Wed May 09, 2012 12:52 am
the different free energy TOTEN in different version

Last post by guo,huaihong « Fri May 04, 2012 12:44 pm
Replies: 1
by guo,huaihong » Fri May 04, 2012 12:38 pm

1 Replies

2878 Views

Last post by guo,huaihong
Fri May 04, 2012 12:44 pm
Different convergence between serial and parallel versions

Last post by alex « Wed May 02, 2012 9:47 am
Replies: 1
by quan.phung » Tue May 01, 2012 6:47 pm

1 Replies

1950 Views

Last post by alex
Wed May 02, 2012 9:47 am
VASP gives an "FFTMPI: Increase NMAXM to 4608" message and exits

Last post by admin « Thu Apr 26, 2012 3:54 pm
Replies: 1
by lowsfer » Thu Apr 26, 2012 7:43 am

1 Replies

2144 Views

Last post by admin
Thu Apr 26, 2012 3:54 pm
B3LYP calculation of single O atom does not converge.

Last post by alex « Thu Apr 26, 2012 9:21 am
Replies: 3
by ynwu » Thu Apr 19, 2012 12:42 am

3 Replies

3955 Views

Last post by alex
Thu Apr 26, 2012 9:21 am
problem with energy convergence

Last post by admin « Tue Apr 24, 2012 1:52 pm
Replies: 1
by Leny » Fri Apr 20, 2012 3:30 am

1 Replies

1922 Views

Last post by admin
Tue Apr 24, 2012 1:52 pm
DFT-D2 on VASP 5.2.11

Last post by santana « Wed Apr 18, 2012 6:02 pm
Replies: 3
by abruix » Wed Mar 09, 2011 9:45 pm

3 Replies

4914 Views

Last post by santana
Wed Apr 18, 2012 6:02 pm
Errors in the GW calculations of Silicon

Last post by ApolloYang « Fri Apr 13, 2012 9:26 am
Replies: 2
by ApolloYang » Fri Mar 23, 2012 4:18 am

2 Replies

3595 Views

Last post by ApolloYang
Fri Apr 13, 2012 9:26 am
Error during band structure calculation

Last post by ApolloYang « Fri Apr 13, 2012 9:22 am
Replies: 3
by magal » Wed Apr 11, 2012 1:23 pm

3 Replies

3109 Views

Last post by ApolloYang
Fri Apr 13, 2012 9:22 am
"ZPOTRF failed!" occurs before first step in PBE+U calc when ISIF=2, but is ok when ISIF=1

Last post by dhfphysics « Thu Apr 12, 2012 6:01 pm
Replies: 2
by dhfphysics » Wed Dec 21, 2011 11:33 pm

2 Replies

3690 Views

Last post by dhfphysics
Thu Apr 12, 2012 6:01 pm
MPI_Cart_create(

Last post by admin « Thu Mar 29, 2012 2:01 pm
Replies: 1
by qpbh08137 » Tue Mar 27, 2012 8:38 am

1 Replies

2486 Views

Last post by admin
Thu Mar 29, 2012 2:01 pm
changing OUTCAR to CONTCAR??

Last post by Leny « Wed Mar 28, 2012 2:05 am
Replies: 2
by Leny » Tue Mar 27, 2012 4:05 pm

2 Replies

2414 Views

Last post by Leny
Wed Mar 28, 2012 2:05 am
Scalability and parallel performance with hybrid functionals

Last post by hipertrofia « Mon Mar 26, 2012 9:19 pm
Replies: 2
by hipertrofia » Mon Mar 26, 2012 3:51 am

2 Replies

2769 Views

Last post by hipertrofia
Mon Mar 26, 2012 9:19 pm
[VASP 5.2.11] bug or feature? PDOS for WC

Last post by maksim « Thu Mar 22, 2012 3:33 pm
Replies: 1
by maksim » Mon Feb 27, 2012 9:29 am

1 Replies

2144 Views

Last post by maksim
Thu Mar 22, 2012 3:33 pm
Problem with using EFIELD_PEAD for MD and relaxation

Last post by Li Huang « Sat Mar 17, 2012 2:58 am
Replies: 1
by huangj3 » Wed Oct 26, 2011 7:40 pm

1 Replies

2329 Views

Last post by Li Huang
Sat Mar 17, 2012 2:58 am
IERR=0 Error reading item 'MAGMOM'

Last post by leonabdalla « Wed Mar 14, 2012 11:28 pm
Replies: 3
by bth20 » Tue Sep 13, 2005 12:11 pm

3 Replies

12741 Views

Last post by leonabdalla
Wed Mar 14, 2012 11:28 pm

New Topic

1424 topics

Page 48 of 72
- Jump to page:
Previous
1
…
46
47
48
49
50
…
72
Next

Return to Board Index

Forum permissions

You cannot post new topics in this forum
You cannot reply to topics in this forum
You cannot edit your posts in this forum
You cannot delete your posts in this forum
You cannot post attachments in this forum