Using VASP

Moderators: Global Moderator, Moderator

New Topic

5382 topics

Page 226 of 270
- Jump to page:
Previous
1
…
224
225
226
227
228
…
270
Next

Topics

Replies

Views

Last post

strange occupation

Last post by admin « Thu Oct 23, 2008 10:20 am
Replies: 5
by deltz » Mon Oct 20, 2008 8:45 am

5 Replies

2414 Views

Last post by admin
Thu Oct 23, 2008 10:20 am
Oxygen dimer

Last post by admin « Thu Oct 23, 2008 10:12 am
Replies: 1
by wipper » Wed Oct 22, 2008 11:53 am

1 Replies

2075 Views

Last post by admin
Thu Oct 23, 2008 10:12 am
MD

Last post by admin « Thu Oct 23, 2008 10:04 am
Replies: 3
by fegg7502 » Fri Oct 17, 2008 2:16 am

3 Replies

1805 Views

Last post by admin
Thu Oct 23, 2008 10:04 am
Spin polarized calculations

Last post by magal « Wed Oct 22, 2008 11:08 am
Replies: 2
by magal » Thu Oct 16, 2008 7:33 am

2 Replies

3532 Views

Last post by magal
Wed Oct 22, 2008 11:08 am
Temperature and energy

Last post by admin « Wed Oct 22, 2008 8:44 am
Replies: 3
by Danny » Mon Oct 20, 2008 3:19 pm

3 Replies

2800 Views

Last post by admin
Wed Oct 22, 2008 8:44 am
partial charge

Last post by admin « Wed Oct 22, 2008 8:23 am
Replies: 3
by rudra-b » Mon Oct 13, 2008 4:25 am

3 Replies

2654 Views

Last post by admin
Wed Oct 22, 2008 8:23 am
core level shifts and average electrostatic potential at each ion

Last post by Jiaye Li « Wed Oct 22, 2008 1:57 am
Replies: 2
by Jiaye Li » Fri Oct 17, 2008 9:13 am

2 Replies

3628 Views

Last post by Jiaye Li
Wed Oct 22, 2008 1:57 am
Question about band structure calculation

Last post by chenweiguang « Mon Oct 20, 2008 1:12 pm
Replies: 2
by chenweiguang » Mon Oct 20, 2008 11:14 am

2 Replies

2257 Views

Last post by chenweiguang
Mon Oct 20, 2008 1:12 pm
Force relaxation and its dependence on EDIFF

Last post by admin « Mon Oct 20, 2008 11:31 am
Replies: 1
by simha » Fri Oct 17, 2008 12:06 pm

1 Replies

2539 Views

Last post by admin
Mon Oct 20, 2008 11:31 am
how to setup the k-points path in a supercell model for the band structure calculation?

Last post by chenweiguang « Mon Oct 20, 2008 10:19 am
Replies: 1
by oxylum » Thu Apr 26, 2007 4:42 am

1 Replies

2378 Views

Last post by chenweiguang
Mon Oct 20, 2008 10:19 am
jellium background

Last post by crazyweed « Thu Oct 16, 2008 5:11 pm
Replies: 1
by crazyweed » Thu Sep 25, 2008 10:24 pm

1 Replies

2999 Views

Last post by crazyweed
Thu Oct 16, 2008 5:11 pm
MD calculations

Last post by fegg7502 « Thu Oct 16, 2008 12:45 pm
Replies: 2
by fegg7502 » Thu Oct 16, 2008 9:37 am

2 Replies

1738 Views

Last post by fegg7502
Thu Oct 16, 2008 12:45 pm
Adding a charge?

Last post by Jiaye Li « Thu Oct 16, 2008 7:45 am
Replies: 3
by Jiaye Li » Thu Oct 09, 2008 4:01 am

3 Replies

3716 Views

Last post by Jiaye Li
Thu Oct 16, 2008 7:45 am
STM simulation

Last post by Danny « Wed Oct 15, 2008 9:24 pm
Replies: 6
by vasplover » Wed Sep 10, 2008 7:29 pm

6 Replies

7253 Views

Last post by Danny
Wed Oct 15, 2008 9:24 pm
core state eigenenergies

Last post by admin « Wed Oct 15, 2008 9:54 am
Replies: 3
by rgc » Thu Oct 02, 2008 2:29 pm

3 Replies

2662 Views

Last post by admin
Wed Oct 15, 2008 9:54 am
average electrostatic potential at the core does not converge

Last post by admin « Wed Oct 15, 2008 9:14 am
Replies: 1
by fzj » Mon Oct 13, 2008 1:38 am

1 Replies

2447 Views

Last post by admin
Wed Oct 15, 2008 9:14 am
How to calculate the stress tensor ?

Last post by admin « Tue Oct 14, 2008 2:12 pm
Replies: 3
by fanghz » Fri Oct 10, 2008 7:38 am

3 Replies

5139 Views

Last post by admin
Tue Oct 14, 2008 2:12 pm
Can direct coordinates be nagative? CONTCAR shows it

Last post by admin « Fri Oct 10, 2008 12:33 pm
Replies: 1
by simha » Fri Oct 10, 2008 9:41 am

1 Replies

2414 Views

Last post by admin
Fri Oct 10, 2008 12:33 pm
error in Berry phase calculation

Last post by lieshan « Thu Oct 09, 2008 6:40 am
Replies: 2
by zhongshanluo » Wed Oct 24, 2007 11:42 am

2 Replies

2252 Views

Last post by lieshan
Thu Oct 09, 2008 6:40 am
magnetic moment

Last post by admin « Wed Oct 08, 2008 12:19 pm
Replies: 1
by linglin » Wed Oct 08, 2008 9:58 am

1 Replies

1924 Views

Last post by admin
Wed Oct 08, 2008 12:19 pm

New Topic

5382 topics

Page 226 of 270
- Jump to page:
Previous
1
…
224
225
226
227
228
…
270
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