Using VASP

Moderators: Global Moderator, Moderator

New Topic

5821 topics

Page 187 of 292
- Jump to page:
Previous
1
…
185
186
187
188
189
…
292
Next

Topics

Replies

Views

Last post

Magnetization Density for noncolinear system

Last post by jlbettis « Tue Apr 09, 2013 6:34 pm
Replies: 1
by tyson » Wed Mar 27, 2013 2:17 am

1 Replies

2998 Views

Last post by jlbettis
Tue Apr 09, 2013 6:34 pm
finding the correct magnetic moment

Last post by admin « Tue Apr 09, 2013 2:45 pm
Replies: 1
by vasp_user » Tue Apr 09, 2013 6:28 am

1 Replies

3273 Views

Last post by admin
Tue Apr 09, 2013 2:45 pm
Determining fractional coordinates in POSC

Last post by admin « Tue Apr 09, 2013 10:26 am
Replies: 2
by chatfat » Mon Apr 08, 2013 6:32 pm

2 Replies

2964 Views

Last post by admin
Tue Apr 09, 2013 10:26 am
Questions about velocities in VASP

Last post by admin « Thu Apr 04, 2013 3:27 pm
Replies: 1
by gael » Fri Mar 29, 2013 11:10 am

1 Replies

4229 Views

Last post by admin
Thu Apr 04, 2013 3:27 pm
Question about band structure and PROCAR

Last post by admin « Wed Apr 03, 2013 3:53 pm
Replies: 1
by blackbarrel » Tue Apr 02, 2013 2:45 pm

1 Replies

3419 Views

Last post by admin
Wed Apr 03, 2013 3:53 pm
van der Waals functional gives positive total energy to Na and K bulk

Last post by nv « Wed Apr 03, 2013 1:49 pm
Replies: 4
by zhaohui » Mon Dec 10, 2012 3:28 pm

4 Replies

7395 Views

Last post by nv
Wed Apr 03, 2013 1:49 pm
Phonons with vasp

Last post by saikat « Tue Apr 02, 2013 4:15 pm
Replies: 3
by saikat » Fri Mar 29, 2013 7:30 pm

3 Replies

3850 Views

Last post by saikat
Tue Apr 02, 2013 4:15 pm
Non-relativistic Pseudopotentials

Last post by annagarden « Tue Apr 02, 2013 12:12 pm
Replies: 4
by annagarden » Thu Mar 21, 2013 5:16 pm

4 Replies

3741 Views

Last post by annagarden
Tue Apr 02, 2013 12:12 pm
The energy of atom is positive or negative？

Last post by bsmile « Mon Apr 01, 2013 4:52 pm
Replies: 4
by dyc_2008 » Wed Mar 16, 2011 12:15 pm

4 Replies

4077 Views

Last post by bsmile
Mon Apr 01, 2013 4:52 pm
Free energy of N2 molecule

Last post by admin « Tue Mar 26, 2013 12:40 pm

by admin » Tue Mar 26, 2013 12:40 pm

0 Replies

2380 Views

Last post by admin
Tue Mar 26, 2013 12:40 pm
GGA + U(R) in VASP

Last post by admin « Tue Mar 26, 2013 11:57 am
Replies: 1
by ccsdt_vasp » Mon Mar 25, 2013 8:39 pm

1 Replies

2929 Views

Last post by admin
Tue Mar 26, 2013 11:57 am
About DIPOL tag

Last post by IGNOTUS « Tue Mar 26, 2013 9:22 am
Replies: 2
by nujjj » Wed Feb 09, 2005 7:48 pm

2 Replies

6374 Views

Last post by IGNOTUS
Tue Mar 26, 2013 9:22 am
How to determine the k point path in band structure calculation?

Last post by wuqisheng « Fri Mar 22, 2013 12:53 pm
Replies: 1
by wuqisheng » Fri Mar 22, 2013 10:39 am

1 Replies

3361 Views

Last post by wuqisheng
Fri Mar 22, 2013 12:53 pm
non-collinear

Last post by parnian « Fri Mar 22, 2013 11:03 am
Replies: 3
by parnian » Wed Mar 20, 2013 2:40 pm

3 Replies

4232 Views

Last post by parnian
Fri Mar 22, 2013 11:03 am
Adsorption of N atom to metal surface

Last post by annagarden « Thu Mar 21, 2013 5:12 pm
Replies: 7
by annagarden » Mon Mar 11, 2013 5:49 pm

7 Replies

8029 Views

Last post by annagarden
Thu Mar 21, 2013 5:12 pm
What does VASP consider a small band gap?

Last post by jlbettis « Wed Mar 20, 2013 5:08 pm
Replies: 2
by jlbettis » Wed Mar 20, 2013 3:32 am

2 Replies

2962 Views

Last post by jlbettis
Wed Mar 20, 2013 5:08 pm
vibrational frequency calculations

Last post by apple « Tue Mar 19, 2013 3:22 pm
Replies: 2
by apple » Fri Mar 15, 2013 8:29 pm

2 Replies

4133 Views

Last post by apple
Tue Mar 19, 2013 3:22 pm
Visualize the Wavefunction

Last post by xcid « Mon Mar 18, 2013 4:03 pm
Replies: 15
by okuno » Mon Aug 17, 2009 10:03 am
1

2
15 Replies

22568 Views

Last post by xcid
Mon Mar 18, 2013 4:03 pm
Total Energy from GW

Last post by admin « Mon Mar 18, 2013 2:22 pm
Replies: 2
by Malediction » Tue Mar 12, 2013 2:13 am

2 Replies

2910 Views

Last post by admin
Mon Mar 18, 2013 2:22 pm
CHGCAR format?

Last post by maartendft « Sat Mar 16, 2013 10:24 pm
Replies: 2
by topl8921 » Wed Feb 20, 2013 1:59 pm

2 Replies

10666 Views

Last post by maartendft
Sat Mar 16, 2013 10:24 pm

New Topic

5821 topics

Page 187 of 292
- Jump to page:
Previous
1
…
185
186
187
188
189
…
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