Using VASP

Moderators: Global Moderator, Moderator

New Topic

5409 topics

Page 254 of 271
- Jump to page:
Previous
1
…
252
253
254
255
256
…
271
Next

Topics

Replies

Views

Last post

Charged atom

Last post by admin « Fri Dec 01, 2006 12:32 pm
Replies: 1
by gutk » Fri Dec 01, 2006 8:27 am

1 Replies

3079 Views

Last post by admin
Fri Dec 01, 2006 12:32 pm
running on condor/globus

Last post by admin « Fri Dec 01, 2006 12:27 pm
Replies: 1
by kanhere » Fri Dec 01, 2006 5:47 am

1 Replies

2585 Views

Last post by admin
Fri Dec 01, 2006 12:27 pm
How to choose ISMEAR for an unknown system

Last post by admin « Thu Nov 30, 2006 2:34 pm
Replies: 2
by forwordom » Thu Nov 30, 2006 9:04 am

2 Replies

3426 Views

Last post by admin
Thu Nov 30, 2006 2:34 pm
What happens at each kpoint ?

Last post by admin « Thu Nov 30, 2006 2:27 pm
Replies: 1
by hcchoi » Thu Nov 30, 2006 7:38 am

1 Replies

2614 Views

Last post by admin
Thu Nov 30, 2006 2:27 pm
optimization of geometry

Last post by admin « Wed Nov 29, 2006 1:29 pm
Replies: 1
by sgoumri » Wed Nov 29, 2006 12:35 pm

1 Replies

2809 Views

Last post by admin
Wed Nov 29, 2006 1:29 pm
what's mean the f/i

Last post by admin « Tue Nov 28, 2006 12:01 pm
Replies: 2
by wsyjsrrp » Tue Nov 28, 2006 2:33 am

2 Replies

3597 Views

Last post by admin
Tue Nov 28, 2006 12:01 pm
To add the frozen core charge to CHGCAR?

Last post by admin « Mon Nov 27, 2006 12:28 pm
Replies: 1
by zhantian » Tue Nov 21, 2006 8:10 am

1 Replies

2792 Views

Last post by admin
Mon Nov 27, 2006 12:28 pm
Restart of frequency calculation

Last post by loschen « Mon Nov 27, 2006 12:10 pm
Replies: 2
by loschen » Thu Nov 16, 2006 2:42 pm

2 Replies

4024 Views

Last post by loschen
Mon Nov 27, 2006 12:10 pm
A question about relativistic effect

Last post by admin « Mon Nov 27, 2006 9:29 am
Replies: 1
by xiaomatao » Sun Nov 19, 2006 2:05 pm

1 Replies

3076 Views

Last post by admin
Mon Nov 27, 2006 9:29 am
Density of States in 1D structures

Last post by admin « Mon Nov 27, 2006 9:27 am
Replies: 1
by Damien » Mon Nov 27, 2006 8:43 am

1 Replies

3176 Views

Last post by admin
Mon Nov 27, 2006 9:27 am
WARNING :stress and forces are not correct

Last post by admin « Mon Nov 27, 2006 9:19 am
Replies: 1
by forwordom » Fri Nov 24, 2006 12:28 pm

1 Replies

3608 Views

Last post by admin
Mon Nov 27, 2006 9:19 am
reference for spin-orbit coupling

Last post by xianghjun « Sun Nov 26, 2006 9:27 pm
Replies: 1
by windiks » Fri Nov 04, 2005 10:59 am

1 Replies

3186 Views

Last post by xianghjun
Sun Nov 26, 2006 9:27 pm
Can I do LDA+SOC+U calculation using vasp?

Last post by xianghjun « Sun Nov 26, 2006 3:03 pm
Replies: 2
by xianghjun » Tue Nov 21, 2006 7:25 pm

2 Replies

3246 Views

Last post by xianghjun
Sun Nov 26, 2006 3:03 pm
TOTEN and KPOINTS

Last post by admin « Fri Nov 24, 2006 12:20 pm
Replies: 2
by TomÃ¡s » Thu Nov 23, 2006 10:38 am

2 Replies

3695 Views

Last post by admin
Fri Nov 24, 2006 12:20 pm
Molecules (ions) in the unitcell

Last post by Danny « Thu Nov 23, 2006 9:11 pm
Replies: 1
by TomÃ¡s » Thu Nov 23, 2006 10:51 am

1 Replies

2945 Views

Last post by Danny
Thu Nov 23, 2006 9:11 pm
how to access to the vibrational frequency in the OUTCAR file!!

Last post by ouarda « Wed Nov 22, 2006 10:26 am
Replies: 2
by ouarda » Sun Nov 19, 2006 3:22 pm

2 Replies

3213 Views

Last post by ouarda
Wed Nov 22, 2006 10:26 am
How to calculate the heat formation.

Last post by wcwang « Wed Nov 22, 2006 4:57 am
Replies: 3
by wcwang » Sat Nov 18, 2006 2:55 am

3 Replies

3677 Views

Last post by wcwang
Wed Nov 22, 2006 4:57 am
Relaxation of the structure. Energy vs stress on atoms criterium

Last post by admin « Tue Nov 21, 2006 3:48 pm
Replies: 1
by TomÃ¡s » Tue Nov 21, 2006 11:39 am

1 Replies

2839 Views

Last post by admin
Tue Nov 21, 2006 3:48 pm
OUTCAR: what is "total charge" and "magnetization (x)" ?

Last post by lahaye « Tue Nov 21, 2006 9:06 am
Replies: 6
by lahaye » Fri Nov 17, 2006 3:04 am

6 Replies

15542 Views

Last post by lahaye
Tue Nov 21, 2006 9:06 am
about "ALGO"

Last post by admin « Tue Nov 21, 2006 8:38 am
Replies: 1
by Piney » Tue Nov 21, 2006 2:03 am

1 Replies

4128 Views

Last post by admin
Tue Nov 21, 2006 8:38 am

New Topic

5409 topics

Page 254 of 271
- Jump to page:
Previous
1
…
252
253
254
255
256
…
271
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