Using VASP

Moderators: Global Moderator, Moderator

New Topic

5839 topics

Page 256 of 292
- Jump to page:
Previous
1
…
254
255
256
257
258
…
292
Next

Topics

Replies

Views

Last post

magnetic moment is negative

Last post by forsdan « Sun Apr 20, 2008 10:28 am
Replies: 3
by enthusiastic » Tue Apr 15, 2008 4:40 am

3 Replies

6683 Views

Last post by forsdan
Sun Apr 20, 2008 10:28 am
spin polarzie and berry phase calculation can not be performed together?

Last post by admin « Thu Apr 10, 2008 2:09 pm
Replies: 1
by YB » Tue Mar 11, 2008 9:28 am

1 Replies

5285 Views

Last post by admin
Thu Apr 10, 2008 2:09 pm
zero bader charge!

Last post by graeme « Wed Apr 09, 2008 2:33 pm
Replies: 1
by fegg7502 » Wed Apr 09, 2008 6:35 am

1 Replies

4865 Views

Last post by graeme
Wed Apr 09, 2008 2:33 pm
pressure

Last post by admin « Wed Apr 09, 2008 9:27 am
Replies: 1
by TAT » Tue Apr 08, 2008 10:43 pm

1 Replies

4347 Views

Last post by admin
Wed Apr 09, 2008 9:27 am
NEB get a larger diffusion barrier

Last post by graeme « Wed Apr 09, 2008 3:24 am
Replies: 3
by Tiger-paw » Tue Apr 08, 2008 9:24 pm

3 Replies

7205 Views

Last post by graeme
Wed Apr 09, 2008 3:24 am
about quadrupole

Last post by admin « Mon Apr 07, 2008 10:05 am
Replies: 2
by deltz » Fri Apr 04, 2008 11:57 am

2 Replies

5000 Views

Last post by admin
Mon Apr 07, 2008 10:05 am
vasp update

Last post by admin « Mon Apr 07, 2008 9:05 am
Replies: 1
by linglin » Wed Mar 26, 2008 6:51 am

1 Replies

4273 Views

Last post by admin
Mon Apr 07, 2008 9:05 am
Band structure----help

Last post by Jiaye Li « Fri Apr 04, 2008 6:28 am
Replies: 2
by Jiaye Li » Tue Apr 01, 2008 1:50 pm

2 Replies

4930 Views

Last post by Jiaye Li
Fri Apr 04, 2008 6:28 am
LSDA+U can switch spin-unpolarized to spin-polarized,possible?

Last post by yuxiao_zihan « Thu Apr 03, 2008 4:31 pm
Replies: 2
by yuxiao_zihan » Tue Apr 01, 2008 2:15 pm

2 Replies

5089 Views

Last post by yuxiao_zihan
Thu Apr 03, 2008 4:31 pm
Band gap calculation: L(S)DA+U INCAR FILE

Last post by admin « Thu Apr 03, 2008 1:35 pm
Replies: 3
by hyon-jee » Mon Mar 17, 2008 11:01 pm

3 Replies

6978 Views

Last post by admin
Thu Apr 03, 2008 1:35 pm
Question on the setting of NELECT

Last post by admin « Thu Apr 03, 2008 1:25 pm
Replies: 1
by deltz » Tue Apr 01, 2008 4:58 am

1 Replies

4497 Views

Last post by admin
Thu Apr 03, 2008 1:25 pm
Problem on Fe slab (15 layers) calculation

Last post by admin « Mon Mar 31, 2008 11:02 am
Replies: 1
by tak » Fri Mar 28, 2008 5:51 pm

1 Replies

5923 Views

Last post by admin
Mon Mar 31, 2008 11:02 am
HELP NEB doesn't converge

Last post by Nikosnikov « Mon Mar 31, 2008 9:03 am
Replies: 4
by Nikosnikov » Tue Mar 18, 2008 9:33 am

4 Replies

18326 Views

Last post by Nikosnikov
Mon Mar 31, 2008 9:03 am
electron DOS smearing...

Last post by odelaire « Mon Mar 31, 2008 12:38 am
Replies: 3
by odelaire » Tue Mar 04, 2008 12:15 am

3 Replies

7936 Views

Last post by odelaire
Mon Mar 31, 2008 12:38 am
a few more questions on magnetic anisotropy

Last post by decai « Thu Mar 27, 2008 3:48 pm
Replies: 2
by decai » Mon Mar 24, 2008 6:02 pm

2 Replies

7744 Views

Last post by decai
Thu Mar 27, 2008 3:48 pm
Strange increase in the energy after complete relaxation

Last post by admin « Thu Mar 27, 2008 1:18 pm
Replies: 4
by boris » Tue Mar 18, 2008 9:20 am

4 Replies

7875 Views

Last post by admin
Thu Mar 27, 2008 1:18 pm
About relaxation

Last post by admin « Thu Mar 27, 2008 10:52 am
Replies: 1
by zhichengzhong » Tue Mar 25, 2008 9:50 am

1 Replies

4380 Views

Last post by admin
Thu Mar 27, 2008 10:52 am
Number of electrons from Projected DOS

Last post by forsdan « Tue Mar 25, 2008 5:15 pm
Replies: 1
by Masoud » Tue Mar 25, 2008 4:56 pm

1 Replies

5064 Views

Last post by forsdan
Tue Mar 25, 2008 5:15 pm
internal error RAD_CHECK_QPAW: QPAW is incorrect

Last post by asaaravindh « Tue Mar 25, 2008 8:53 am
Replies: 1
by asaaravindh » Tue Mar 25, 2008 6:35 am

1 Replies

4127 Views

Last post by asaaravindh
Tue Mar 25, 2008 8:53 am
geometry minimization

Last post by rudra-b « Mon Mar 24, 2008 8:20 am
Replies: 1
by vasp » Tue Mar 18, 2008 11:18 am

1 Replies

4320 Views

Last post by rudra-b
Mon Mar 24, 2008 8:20 am

New Topic

5839 topics

Page 256 of 292
- Jump to page:
Previous
1
…
254
255
256
257
258
…
292
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