Using VASP

Moderators: Global Moderator, Moderator

New Topic

5557 topics

Page 274 of 278
- Jump to page:
Previous
1
…
272
273
274
275
276
…
278
Next

Topics

Replies

Views

Last post

Charge on the dangling bonds

Last post by admin « Tue Feb 07, 2006 11:29 am
Replies: 3
by des » Mon Jan 23, 2006 11:11 pm

3 Replies

12777 Views

Last post by admin
Tue Feb 07, 2006 11:29 am
"direct" fractional coordinates

Last post by fabella « Fri Feb 03, 2006 6:04 pm
Replies: 2
by fabella » Fri Feb 03, 2006 6:59 am

2 Replies

18394 Views

Last post by fabella
Fri Feb 03, 2006 6:04 pm
What do the two values for a phase factor mean?

Last post by jlrch « Thu Feb 02, 2006 6:07 pm
Replies: 3
by jlrch » Thu Feb 02, 2006 10:28 am

3 Replies

12642 Views

Last post by jlrch
Thu Feb 02, 2006 6:07 pm
Why symmetry constrain fails for ionic relaxation

Last post by Veronika « Thu Feb 02, 2006 1:02 pm
Replies: 4
by gabral » Tue Jan 31, 2006 12:15 pm

4 Replies

16219 Views

Last post by Veronika
Thu Feb 02, 2006 1:02 pm
ALGO-tag

Last post by admin « Mon Jan 30, 2006 2:40 pm
Replies: 3
by Tyx » Fri Jan 27, 2006 4:42 pm

3 Replies

14126 Views

Last post by admin
Mon Jan 30, 2006 2:40 pm
WARNING: stress and forces are not correct

Last post by admin « Thu Jan 26, 2006 2:53 pm
Replies: 1
by Damien » Mon Jan 23, 2006 12:18 pm

1 Replies

14846 Views

Last post by admin
Thu Jan 26, 2006 2:53 pm
Calculations apparently is hanging

Last post by admin « Thu Jan 26, 2006 2:31 pm
Replies: 11
by Rad Balu » Tue Jan 03, 2006 12:10 am

11 Replies

38362 Views

Last post by admin
Thu Jan 26, 2006 2:31 pm
application to nano tubes

Last post by Damien « Wed Jan 25, 2006 1:22 pm
Replies: 4
by saurabhroy » Wed Dec 28, 2005 7:43 pm

4 Replies

15677 Views

Last post by Damien
Wed Jan 25, 2006 1:22 pm
calculating migration barrier energy using selective dynamics

Last post by tjf « Mon Jan 23, 2006 9:30 pm
Replies: 4
by hyon-jee » Thu Jan 19, 2006 11:25 pm

4 Replies

18066 Views

Last post by tjf
Mon Jan 23, 2006 9:30 pm
IBRION=2

Last post by tjf « Sun Jan 22, 2006 12:26 pm
Replies: 5
by fabella » Thu Jan 19, 2006 6:16 pm

5 Replies

20463 Views

Last post by tjf
Sun Jan 22, 2006 12:26 pm
About"WARNING: wrap around errors must be expected"

Last post by Tyx « Fri Jan 20, 2006 11:48 am
Replies: 3
by zhuanghl » Tue Jan 03, 2006 9:31 am

3 Replies

20369 Views

Last post by Tyx
Fri Jan 20, 2006 11:48 am
SIGMA effect on the total energy

Last post by admin « Wed Jan 18, 2006 2:42 pm
Replies: 1
by zhuanghl » Wed Jan 11, 2006 1:15 pm

1 Replies

12389 Views

Last post by admin
Wed Jan 18, 2006 2:42 pm
calcs on 4f-transition metals

Last post by admin « Wed Jan 18, 2006 10:52 am
Replies: 1
by Tiger-paw » Tue Jan 17, 2006 11:16 pm

1 Replies

10165 Views

Last post by admin
Wed Jan 18, 2006 10:52 am
about "external pressure"

Last post by admin « Tue Jan 17, 2006 11:29 am
Replies: 1
by zhuanghl » Sun Jan 01, 2006 9:04 am

1 Replies

10976 Views

Last post by admin
Tue Jan 17, 2006 11:29 am
What does it mean?

Last post by admin « Mon Jan 16, 2006 1:45 pm
Replies: 1
by zhuanghl » Thu Jan 12, 2006 12:38 pm

1 Replies

10171 Views

Last post by admin
Mon Jan 16, 2006 1:45 pm
magnetization density of overlapping atoms calculated

Last post by admin « Mon Jan 16, 2006 1:21 pm
Replies: 1
by hyon-jee » Fri Jan 13, 2006 12:55 am

1 Replies

12503 Views

Last post by admin
Mon Jan 16, 2006 1:21 pm
No convergence with Pr

Last post by tjf « Thu Jan 12, 2006 11:06 am
Replies: 1
by tjf » Tue Jan 10, 2006 3:19 pm

1 Replies

11188 Views

Last post by tjf
Thu Jan 12, 2006 11:06 am
Real space projector?

Last post by fabella « Tue Jan 10, 2006 5:15 pm
Replies: 2
by fabella » Mon Jan 09, 2006 10:03 pm

2 Replies

15260 Views

Last post by fabella
Tue Jan 10, 2006 5:15 pm
Dealing with the unconverged problem

Last post by admin « Tue Jan 10, 2006 10:15 am
Replies: 2
by zhuanghl » Fri Jan 06, 2006 6:25 pm

2 Replies

15006 Views

Last post by admin
Tue Jan 10, 2006 10:15 am
Meta GGA

Last post by admin « Tue Jan 10, 2006 8:34 am
Replies: 1
by bruent » Mon Jan 09, 2006 7:10 am

1 Replies

12338 Views

Last post by admin
Tue Jan 10, 2006 8:34 am

New Topic

5557 topics

Page 274 of 278
- Jump to page:
Previous
1
…
272
273
274
275
276
…
278
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