Using VASP

Moderators: Global Moderator, Moderator

New Topic

5335 topics

Page 224 of 267
- Jump to page:
Previous
1
…
222
223
224
225
226
…
267
Next

Topics

Replies

Views

Last post

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

2167 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

2489 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

2299 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

2941 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

1694 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

3632 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

7099 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

2581 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

2372 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

5023 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

2350 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

2192 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

1864 Views

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

Last post by admin « Tue Oct 07, 2008 2:36 pm
Replies: 3
by Amritendu » Tue Jun 24, 2008 3:14 pm

3 Replies

2652 Views

Last post by admin
Tue Oct 07, 2008 2:36 pm
Atomic Energy of P

Last post by admin « Tue Oct 07, 2008 2:31 pm
Replies: 3
by Oscar_rp » Mon Oct 06, 2008 2:58 pm

3 Replies

2126 Views

Last post by admin
Tue Oct 07, 2008 2:31 pm
Bulk silver - lattice constant calculations

Last post by admin « Tue Oct 07, 2008 2:19 pm
Replies: 1
by physicalattraction » Mon Oct 06, 2008 3:48 pm

1 Replies

3629 Views

Last post by admin
Tue Oct 07, 2008 2:19 pm
convergence problem in vasp.4.6.35

Last post by deltz « Sun Oct 05, 2008 8:31 am
Replies: 1
by deltz » Thu Oct 02, 2008 12:00 pm

1 Replies

1779 Views

Last post by deltz
Sun Oct 05, 2008 8:31 am
Total charge

Last post by forsdan « Fri Oct 03, 2008 9:54 pm
Replies: 1
by jhlee » Fri Oct 03, 2008 9:36 pm

1 Replies

1764 Views

Last post by forsdan
Fri Oct 03, 2008 9:54 pm
Technical question with P%PSPRNL and P%WPS

Last post by ykent « Thu Oct 02, 2008 9:46 pm
Replies: 1
by ykent » Thu Oct 02, 2008 8:26 pm

1 Replies

1514 Views

Last post by ykent
Thu Oct 02, 2008 9:46 pm
Bulk moduli

Last post by forsdan « Wed Oct 01, 2008 4:39 pm
Replies: 3
by goja25 » Tue Sep 30, 2008 2:12 pm

3 Replies

3636 Views

Last post by forsdan
Wed Oct 01, 2008 4:39 pm

New Topic

5335 topics

Page 224 of 267
- Jump to page:
Previous
1
…
222
223
224
225
226
…
267
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