Using VASP

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electronic convergence problem in interface structure

Last post by fatihgsen « Mon Jan 05, 2009 9:05 pm
Replies: 1
by fatihgsen » Sat Jan 03, 2009 10:35 pm

1 Replies

1419 Views

Last post by fatihgsen
Mon Jan 05, 2009 9:05 pm
about "external pressure"

Last post by d-farrell2 « Tue Dec 30, 2008 6:11 pm
Replies: 5
by hehui » Mon Aug 07, 2006 1:22 am

5 Replies

10601 Views

Last post by d-farrell2
Tue Dec 30, 2008 6:11 pm
plotting bandstructure

Last post by liuhongfei « Tue Dec 23, 2008 9:57 am
Replies: 1
by asaaravindh » Tue Dec 23, 2008 6:20 am

1 Replies

2052 Views

Last post by liuhongfei
Tue Dec 23, 2008 9:57 am
detemination of ISMEAR and sigma

Last post by admin « Fri Dec 19, 2008 1:52 pm
Replies: 1
by luke419 » Thu Dec 18, 2008 3:57 am

1 Replies

2134 Views

Last post by admin
Fri Dec 19, 2008 1:52 pm
How accorate for VASP to hadle priodic system?

Last post by admin « Fri Dec 19, 2008 1:39 pm
Replies: 1
by yangsw » Tue Dec 16, 2008 3:30 am

1 Replies

1687 Views

Last post by admin
Fri Dec 19, 2008 1:39 pm
DOSCAR

Last post by admin « Mon Dec 15, 2008 2:22 pm
Replies: 1
by TAT » Mon Dec 15, 2008 2:20 am

1 Replies

1944 Views

Last post by admin
Mon Dec 15, 2008 2:22 pm
Helical spin calculations

Last post by user44 « Mon Dec 15, 2008 2:19 pm
Replies: 1
by jctung » Thu Nov 06, 2008 9:26 am

1 Replies

2208 Views

Last post by user44
Mon Dec 15, 2008 2:19 pm
Explosion of the bulk structure

Last post by admin « Fri Dec 12, 2008 1:39 pm
Replies: 1
by Oscar_rp » Fri Dec 12, 2008 8:08 am

1 Replies

1831 Views

Last post by admin
Fri Dec 12, 2008 1:39 pm
What is the meaning of this?

Last post by TAT « Wed Dec 10, 2008 6:03 am
Replies: 4
by Piney » Tue Nov 14, 2006 3:03 am

4 Replies

4228 Views

Last post by TAT
Wed Dec 10, 2008 6:03 am
Born effective charge tensor

Last post by rudra-b « Tue Dec 02, 2008 6:27 am
Replies: 5
by rudra-b » Tue Nov 18, 2008 6:29 am

5 Replies

4538 Views

Last post by rudra-b
Tue Dec 02, 2008 6:27 am
optics error

Last post by linglin « Tue Dec 02, 2008 1:53 am
Replies: 3
by linglin » Sun Nov 30, 2008 9:45 am

3 Replies

1843 Views

Last post by linglin
Tue Dec 02, 2008 1:53 am
Can we use HSE03 or 06 functional

Last post by admin « Mon Dec 01, 2008 1:43 pm
Replies: 1
by simha » Sat Nov 29, 2008 9:57 pm

1 Replies

3590 Views

Last post by admin
Mon Dec 01, 2008 1:43 pm
convergence problem

Last post by admin « Wed Nov 26, 2008 2:33 pm
Replies: 7
by TAT » Wed Nov 19, 2008 4:27 am

7 Replies

4180 Views

Last post by admin
Wed Nov 26, 2008 2:33 pm
problem with PAW potentials

Last post by admin « Wed Nov 26, 2008 1:40 pm
Replies: 2
by TAT » Wed Nov 19, 2008 7:27 pm

2 Replies

2431 Views

Last post by admin
Wed Nov 26, 2008 1:40 pm
various questions on VASP

Last post by admin « Wed Nov 26, 2008 11:31 am
Replies: 1
by luke419 » Wed Nov 19, 2008 7:18 am

1 Replies

2856 Views

Last post by admin
Wed Nov 26, 2008 11:31 am
NBANDS & LMAXMIX

Last post by admin « Wed Nov 26, 2008 11:06 am
Replies: 1
by TAT » Sun Nov 23, 2008 12:32 am

1 Replies

3806 Views

Last post by admin
Wed Nov 26, 2008 11:06 am
Electric Field step by step???

Last post by lcyin « Tue Nov 25, 2008 8:45 am
Replies: 2
by slavik » Tue Jun 10, 2008 10:19 pm

2 Replies

4222 Views

Last post by lcyin
Tue Nov 25, 2008 8:45 am
FERWE sintaxis

Last post by admin « Thu Nov 20, 2008 4:23 pm
Replies: 1
by bf2204 » Tue Nov 18, 2008 1:22 pm

1 Replies

1584 Views

Last post by admin
Thu Nov 20, 2008 4:23 pm
k point sampling

Last post by Jiaye Li « Tue Nov 18, 2008 5:21 am
Replies: 5
by Jiaye Li » Tue Oct 28, 2008 9:34 am

5 Replies

2648 Views

Last post by Jiaye Li
Tue Nov 18, 2008 5:21 am
CHGCAR & Guidebook: what is Vcell?

Last post by admin « Mon Nov 17, 2008 1:58 pm
Replies: 6
by lahaye » Mon May 15, 2006 5:54 am

6 Replies

3734 Views

Last post by admin
Mon Nov 17, 2008 1:58 pm

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