Using VASP

Moderators: Global Moderator, Moderator

New Topic

5549 topics

Page 215 of 278
- Jump to page:
Previous
1
…
213
214
215
216
217
…
278
Next

Topics

Replies

Views

Last post

Convergence problem

Last post by vasp16888 « Thu May 06, 2010 10:22 pm
Replies: 19
by vasp16888 » Fri Apr 23, 2010 4:13 am
1

2
19 Replies

14542 Views

Last post by vasp16888
Thu May 06, 2010 10:22 pm
plot of charge density

Last post by Danny « Thu May 06, 2010 10:06 am
Replies: 4
by xgxu » Wed May 05, 2010 9:56 am

4 Replies

4869 Views

Last post by Danny
Thu May 06, 2010 10:06 am
hit a member that was already found in another star

Last post by panda « Wed May 05, 2010 6:19 pm
Replies: 4
by neo » Sat May 01, 2010 7:51 pm

4 Replies

4009 Views

Last post by panda
Wed May 05, 2010 6:19 pm
[color=red][b]Very weird problem[/b][/color] about K points convergence check

Last post by alex « Wed May 05, 2010 3:03 pm
Replies: 15
by vasp16888 » Fri Apr 23, 2010 11:25 pm
1

2
15 Replies

9592 Views

Last post by alex
Wed May 05, 2010 3:03 pm
Restarting a Hessian calculation

Last post by laurent.pedesseau « Wed May 05, 2010 7:31 am
Replies: 3
by Vlad » Wed Apr 21, 2010 1:39 am

3 Replies

3218 Views

Last post by laurent.pedesseau
Wed May 05, 2010 7:31 am
Phase factors in PROCAR

Last post by Hugo Strand « Tue May 04, 2010 1:51 pm
Replies: 2
by georg » Thu Jul 28, 2005 8:49 pm

2 Replies

6688 Views

Last post by Hugo Strand
Tue May 04, 2010 1:51 pm
IBRION=5 : from Hessian matrix to phonon dispersion; how?

Last post by Danny « Tue May 04, 2010 12:47 pm
Replies: 7
by lahaye » Thu Aug 03, 2006 6:13 am

7 Replies

9592 Views

Last post by Danny
Tue May 04, 2010 12:47 pm
How to improve parallelised calculation ?

Last post by vasp16888 « Mon May 03, 2010 11:10 pm
Replies: 12
by vasp16888 » Sun Apr 25, 2010 8:41 pm

12 Replies

7956 Views

Last post by vasp16888
Mon May 03, 2010 11:10 pm
Phonon Dispersion Problem

Last post by forsdan « Mon May 03, 2010 5:06 pm
Replies: 2
by w008egs » Sun May 02, 2010 7:44 pm

2 Replies

5481 Views

Last post by forsdan
Mon May 03, 2010 5:06 pm
Monoclinic cell parameters optimisation

Last post by naidu « Mon May 03, 2010 2:00 pm
Replies: 2
by naidu » Thu Apr 22, 2010 10:53 am

2 Replies

2789 Views

Last post by naidu
Mon May 03, 2010 2:00 pm
Differences in the Magnetic Moments of PAW_GGA and GGA

Last post by forsdan « Sun May 02, 2010 6:34 pm
Replies: 1
by gferguson » Wed Apr 28, 2010 2:22 pm

1 Replies

2672 Views

Last post by forsdan
Sun May 02, 2010 6:34 pm
antiferromagnetic and ferrimagnetic

Last post by forsdan « Sun May 02, 2010 5:29 pm
Replies: 1
by k-oikawa » Tue Apr 27, 2010 2:02 am

1 Replies

2985 Views

Last post by forsdan
Sun May 02, 2010 5:29 pm
Setting RWIGS

Last post by bp249507 « Thu Apr 29, 2010 5:12 am
Replies: 4
by binayprasai » Sat Apr 24, 2010 5:33 pm

4 Replies

3692 Views

Last post by bp249507
Thu Apr 29, 2010 5:12 am
psdopotential for hybrid functional and revised PBE

Last post by KurtG « Wed Apr 28, 2010 1:48 am
Replies: 2
by KurtG » Tue Apr 27, 2010 9:12 am

2 Replies

3322 Views

Last post by KurtG
Wed Apr 28, 2010 1:48 am
PAW-LDA Yb potential file

Last post by Danny « Tue Apr 27, 2010 2:25 pm
Replies: 1
by Danny » Tue Apr 27, 2010 1:27 pm

1 Replies

2505 Views

Last post by Danny
Tue Apr 27, 2010 2:25 pm
Visualize VASP output files

Last post by Danny « Tue Apr 27, 2010 1:29 pm
Replies: 1
by Rayan » Sun Apr 25, 2010 2:55 pm

1 Replies

3784 Views

Last post by Danny
Tue Apr 27, 2010 1:29 pm
Temperature during molecular dynamics

Last post by neo « Sun Apr 25, 2010 5:02 pm
Replies: 2
by neo » Sun Apr 25, 2010 11:14 am

2 Replies

5873 Views

Last post by neo
Sun Apr 25, 2010 5:02 pm
Using AM05 calculate the bandstructure facing the questions?

Last post by forsdan « Sat Apr 24, 2010 8:43 pm
Replies: 4
by VASP001 » Tue Apr 13, 2010 2:07 am

4 Replies

3954 Views

Last post by forsdan
Sat Apr 24, 2010 8:43 pm
How to calculate ionization potential and electron affinity?

Last post by tlchan « Thu Apr 22, 2010 1:35 pm
Replies: 1
by YunLi » Thu Apr 22, 2010 4:37 am

1 Replies

4649 Views

Last post by tlchan
Thu Apr 22, 2010 1:35 pm
How to set the RWIGS tag in INCAR??

Last post by amul1umt « Wed Apr 21, 2010 8:30 pm
Replies: 2
by wfei » Thu Apr 20, 2006 1:26 pm

2 Replies

3142 Views

Last post by amul1umt
Wed Apr 21, 2010 8:30 pm

New Topic

5549 topics

Page 215 of 278
- Jump to page:
Previous
1
…
213
214
215
216
217
…
278
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