Using VASP

Moderators: Global Moderator, Moderator

New Topic

5825 topics

Page 210 of 292
- Jump to page:
Previous
1
…
208
209
210
211
212
…
292
Next

Topics

Replies

Views

Last post

change in k-point error

Last post by uccakar « Sat Aug 13, 2011 8:58 pm
Replies: 2
by uccakar » Sat Aug 13, 2011 4:08 pm

2 Replies

7687 Views

Last post by uccakar
Sat Aug 13, 2011 8:58 pm
poscar for cnt

Last post by alex « Thu Aug 11, 2011 5:48 pm
Replies: 1
by revanth » Thu Aug 11, 2011 3:31 pm

1 Replies

2752 Views

Last post by alex
Thu Aug 11, 2011 5:48 pm
velocity Correlation function related to viscosity

Last post by ukponga « Thu Aug 11, 2011 1:16 pm
Replies: 2
by s9811016 » Sun Jul 24, 2011 12:14 am

2 Replies

3845 Views

Last post by ukponga
Thu Aug 11, 2011 1:16 pm
surface with adsorbates

Last post by apple « Wed Aug 10, 2011 11:26 pm
Replies: 6
by apple » Fri Jul 22, 2011 3:24 am

6 Replies

5371 Views

Last post by apple
Wed Aug 10, 2011 11:26 pm
Bandgap from multiple k-points

Last post by tlchan « Wed Aug 10, 2011 10:46 am
Replies: 1
by Dr Vitaly V. G. Chaban » Mon Aug 08, 2011 10:51 pm

1 Replies

3236 Views

Last post by tlchan
Wed Aug 10, 2011 10:46 am
Hybrid functional spin-polarized calculation

Last post by whao137 « Tue Aug 09, 2011 5:54 pm
Replies: 2
by whao137 » Tue Aug 09, 2011 2:35 pm

2 Replies

3566 Views

Last post by whao137
Tue Aug 09, 2011 5:54 pm
converging ions with VASP5.2

Last post by Danny « Sun Aug 07, 2011 3:11 pm
Replies: 4
by Danny » Tue Jul 12, 2011 7:37 pm

4 Replies

4861 Views

Last post by Danny
Sun Aug 07, 2011 3:11 pm
How to determine fermi level in DOS calculation of a bulk crystallite

Last post by tlchan « Sat Aug 06, 2011 7:56 pm
Replies: 1
by lamha » Thu Aug 04, 2011 3:47 am

1 Replies

4382 Views

Last post by tlchan
Sat Aug 06, 2011 7:56 pm
Problem on Berry phase calculation

Last post by jlbettis « Thu Aug 04, 2011 2:00 am
Replies: 2
by ericsun » Sun Apr 09, 2006 9:09 am

2 Replies

4886 Views

Last post by jlbettis
Thu Aug 04, 2011 2:00 am
entropy calculations

Last post by kambiz « Wed Aug 03, 2011 7:09 am
Replies: 1
by Babeusz » Tue Aug 02, 2011 12:57 pm

1 Replies

3616 Views

Last post by kambiz
Wed Aug 03, 2011 7:09 am
Elastic band method

Last post by sharma « Mon Aug 01, 2011 7:08 am
Replies: 2
by sharma » Thu Jul 28, 2011 4:37 am

2 Replies

3333 Views

Last post by sharma
Mon Aug 01, 2011 7:08 am
cohesive energy

Last post by forsdan « Fri Jul 29, 2011 11:20 am
Replies: 4
by musharaf » Wed Jul 27, 2011 4:48 pm

4 Replies

6514 Views

Last post by forsdan
Fri Jul 29, 2011 11:20 am
Ce 4f U=5 and intermetallic bonding with Rh

Last post by rgc « Thu Jul 28, 2011 3:21 pm
Replies: 1
by Sonny » Thu Jul 14, 2011 7:07 am

1 Replies

2828 Views

Last post by rgc
Thu Jul 28, 2011 3:21 pm
How to do Accurate spin polarized DOS calculation?

Last post by vasp_fan « Wed Jul 27, 2011 11:28 am
Replies: 1
by bikash » Tue Jul 19, 2011 7:59 pm

1 Replies

6124 Views

Last post by vasp_fan
Wed Jul 27, 2011 11:28 am
Unit Density of States

Last post by tlchan « Tue Jul 26, 2011 4:30 pm
Replies: 6
by hpaudel » Sun Jul 17, 2011 9:37 pm

6 Replies

7587 Views

Last post by tlchan
Tue Jul 26, 2011 4:30 pm
Negative and positive charge density isosurface mix up?

Last post by kzhuo3 « Tue Jul 26, 2011 12:06 pm
Replies: 2
by kzhuo3 » Fri Jul 15, 2011 11:18 am

2 Replies

5192 Views

Last post by kzhuo3
Tue Jul 26, 2011 12:06 pm
How to consider a charge ordering?

Last post by odkhuu « Tue Jul 26, 2011 10:04 am
Replies: 7
by odkhuu » Sun Jul 17, 2011 6:19 am

7 Replies

7441 Views

Last post by odkhuu
Tue Jul 26, 2011 10:04 am
RMSD from VASP output

Last post by s9811016 « Sun Jul 24, 2011 12:02 am
Replies: 1
by Dr Vitaly V. G. Chaban » Mon Jul 18, 2011 11:15 pm

1 Replies

3064 Views

Last post by s9811016
Sun Jul 24, 2011 12:02 am
formation energy of N in ZnO

Last post by superyoyo « Fri Jul 22, 2011 5:57 am
Replies: 2
by mila880227 » Thu Jul 14, 2011 4:29 am

2 Replies

3573 Views

Last post by superyoyo
Fri Jul 22, 2011 5:57 am
Atomization energy of small molecules

Last post by jber « Thu Jul 21, 2011 7:15 pm
Replies: 2
by Joan Adler » Wed Jul 20, 2011 2:28 pm

2 Replies

4801 Views

Last post by jber
Thu Jul 21, 2011 7:15 pm

New Topic

5825 topics

Page 210 of 292
- Jump to page:
Previous
1
…
208
209
210
211
212
…
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