Using VASP

Moderators: Global Moderator, Moderator

New Topic

5594 topics

Page 167 of 280
- Jump to page:
Previous
1
…
165
166
167
168
169
…
280
Next

Topics

Replies

Views

Last post

sleazy optimization to save time

Last post by alex « Mon Dec 09, 2013 10:50 am
Replies: 6
by jasius » Thu Dec 05, 2013 2:52 pm

6 Replies

4227 Views

Last post by alex
Mon Dec 09, 2013 10:50 am
Relaxation of N2 molecule

Last post by karthik1124 « Fri Dec 06, 2013 10:53 pm
Replies: 2
by karthik1124 » Wed Dec 04, 2013 4:54 pm

2 Replies

3336 Views

Last post by karthik1124
Fri Dec 06, 2013 10:53 pm
Band structure and Dos calculations give different Fermi levels

Last post by admin « Fri Dec 06, 2013 3:42 pm
Replies: 1
by hosfa » Fri Dec 06, 2013 12:23 am

1 Replies

2512 Views

Last post by admin
Fri Dec 06, 2013 3:42 pm
Efficient NEB setup

Last post by duncand « Thu Dec 05, 2013 12:41 am
Replies: 2
by duncand » Wed Dec 04, 2013 1:52 am

2 Replies

3326 Views

Last post by duncand
Thu Dec 05, 2013 12:41 am
Relaxation of monoclinic WO3 with tilting

Last post by butt sb « Wed Dec 04, 2013 2:01 pm
Replies: 3
by wwwennie » Tue Nov 19, 2013 10:40 pm

3 Replies

3319 Views

Last post by butt sb
Wed Dec 04, 2013 2:01 pm
Relaxation of Graphite

Last post by farzaneh « Mon Dec 02, 2013 6:33 pm
Replies: 2
by farzaneh » Sun Dec 01, 2013 8:53 am

2 Replies

2829 Views

Last post by farzaneh
Mon Dec 02, 2013 6:33 pm
MD Restart Pbm

Last post by admin « Mon Dec 02, 2013 4:14 pm
Replies: 1
by kmkumar » Sun Nov 24, 2013 11:56 pm

1 Replies

2325 Views

Last post by admin
Mon Dec 02, 2013 4:14 pm
site projected DOS for a spin-polarized system

Last post by admin « Mon Dec 02, 2013 4:12 pm
Replies: 1
by elhmo » Wed Nov 27, 2013 1:37 pm

1 Replies

2434 Views

Last post by admin
Mon Dec 02, 2013 4:12 pm
Positive Energy and Hanging on first few electronic steps in supercell

Last post by admin « Mon Dec 02, 2013 4:08 pm
Replies: 4
by wwwennie » Mon Nov 18, 2013 2:20 am

4 Replies

4374 Views

Last post by admin
Mon Dec 02, 2013 4:08 pm
Too Small Band Gap of Silicon (~0.65 eV) Calculated by VASP

Last post by kzhuo3 « Mon Dec 02, 2013 7:28 am
Replies: 1
by wenpengzhu » Sun Dec 01, 2013 10:22 pm

1 Replies

5328 Views

Last post by kzhuo3
Mon Dec 02, 2013 7:28 am
Band structure for a non relaxed cell

Last post by Nice « Thu Nov 28, 2013 3:14 pm
Replies: 1
by Nice » Wed Nov 27, 2013 1:50 pm

1 Replies

2020 Views

Last post by Nice
Thu Nov 28, 2013 3:14 pm
KPOINT effect in surface energy calculations

Last post by ccccc « Wed Nov 27, 2013 11:53 pm
Replies: 9
by ccccc » Mon Nov 25, 2013 6:22 pm

9 Replies

8698 Views

Last post by ccccc
Wed Nov 27, 2013 11:53 pm
lattice basis and selective dynamics

Last post by Nice « Wed Nov 27, 2013 5:36 pm
Replies: 2
by rpnabar » Mon Jul 17, 2006 1:53 pm

2 Replies

3354 Views

Last post by Nice
Wed Nov 27, 2013 5:36 pm
BSE calculation

Last post by yunhailiseu « Wed Nov 27, 2013 2:31 pm
Replies: 18
by giacomo giorgi » Sat Feb 16, 2013 7:12 am
1

2
18 Replies

22402 Views

Last post by yunhailiseu
Wed Nov 27, 2013 2:31 pm
Can't reproduce antiferromagnetic behavior

Last post by elhmo « Wed Nov 27, 2013 2:29 pm
Replies: 3
by TLV » Sun Nov 24, 2013 11:00 am

3 Replies

3536 Views

Last post by elhmo
Wed Nov 27, 2013 2:29 pm
format of spin polarized LOCPOT

Last post by elhmo « Wed Nov 27, 2013 2:22 pm
Replies: 1
by alpha » Fri Nov 22, 2013 2:45 am

1 Replies

2501 Views

Last post by elhmo
Wed Nov 27, 2013 2:22 pm
How do I simulate Scanning Tunneling microscope image?

Last post by alizah « Wed Nov 20, 2013 11:17 am
Replies: 3
by vasplover » Wed Oct 31, 2007 7:55 pm

3 Replies

5941 Views

Last post by alizah
Wed Nov 20, 2013 11:17 am
Fluorine INCAR

Last post by alex « Mon Nov 18, 2013 4:56 pm
Replies: 1
by nawwara » Mon Nov 18, 2013 4:10 pm

1 Replies

2189 Views

Last post by alex
Mon Nov 18, 2013 4:56 pm
Optical Properties using GW approximation

Last post by giacomo giorgi « Sat Nov 16, 2013 11:54 am
Replies: 1
by hpaudel » Thu Nov 14, 2013 8:16 pm

1 Replies

3334 Views

Last post by giacomo giorgi
Sat Nov 16, 2013 11:54 am
What is this? ERROR ROTDIA

Last post by ccccc « Fri Nov 15, 2013 2:57 pm
Replies: 1
by ccccc » Fri Nov 15, 2013 2:16 pm

1 Replies

2602 Views

Last post by ccccc
Fri Nov 15, 2013 2:57 pm

New Topic

5594 topics

Page 167 of 280
- Jump to page:
Previous
1
…
165
166
167
168
169
…
280
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