Using VASP

Moderators: Global Moderator, Moderator

New Topic

5410 topics

Page 207 of 271
- Jump to page:
Previous
1
…
205
206
207
208
209
…
271
Next

Topics

Replies

Views

Last post

how to extract the bands of surface states from the band structure plot?

Last post by forsdan « Fri May 28, 2010 12:49 pm
Replies: 6
by zzhlax » Mon May 24, 2010 3:09 pm

6 Replies

4466 Views

Last post by forsdan
Fri May 28, 2010 12:49 pm
Different results in DOSCAR file when NUPDOWN flag is used

Last post by ledssiul « Thu May 27, 2010 7:08 pm
Replies: 2
by ledssiul » Wed May 26, 2010 9:04 am

2 Replies

2537 Views

Last post by ledssiul
Thu May 27, 2010 7:08 pm
Hydrogen termination of Si(100)

Last post by Danny « Thu May 27, 2010 8:01 am
Replies: 5
by supreme_general » Wed May 26, 2010 8:02 am

5 Replies

3843 Views

Last post by Danny
Thu May 27, 2010 8:01 am
problem in HSE calculation!

Last post by fzcsydl « Wed May 26, 2010 10:59 pm
Replies: 2
by fzcsydl » Tue May 25, 2010 11:00 pm

2 Replies

2423 Views

Last post by fzcsydl
Wed May 26, 2010 10:59 pm
Surface Si(111) Hydrogen terminated + Molecule

Last post by Oscar_rp « Wed May 26, 2010 7:44 pm
Replies: 2
by Oscar_rp » Wed May 26, 2010 9:09 am

2 Replies

2035 Views

Last post by Oscar_rp
Wed May 26, 2010 7:44 pm
negative fermi energy- surface calculations

Last post by forsdan « Wed May 26, 2010 5:22 pm
Replies: 5
by kamala » Fri May 21, 2010 7:45 am

5 Replies

4094 Views

Last post by forsdan
Wed May 26, 2010 5:22 pm
Problems with GaAs bandgap with HSE hybrid functional (VASP 5.2)

Last post by dhfphysics « Wed May 26, 2010 3:20 am
Replies: 1
by Eugene » Mon Jul 27, 2009 7:44 pm

1 Replies

5356 Views

Last post by dhfphysics
Wed May 26, 2010 3:20 am
Magnetic anisotropy energy of bulk Cobalt

Last post by vasp16888 « Tue May 25, 2010 9:24 pm
Replies: 3
by prasen » Mon Mar 15, 2010 6:08 am

3 Replies

4241 Views

Last post by vasp16888
Tue May 25, 2010 9:24 pm
About the calculation of magnetic anistropies energy

Last post by vasp16888 « Tue May 25, 2010 6:32 pm
Replies: 5
by okuno » Fri Oct 17, 2008 1:35 pm

5 Replies

7468 Views

Last post by vasp16888
Tue May 25, 2010 6:32 pm
ISOTOPE CALCULATION

Last post by forsdan « Mon May 24, 2010 2:48 pm
Replies: 1
by Maximus » Mon May 24, 2010 7:33 am

1 Replies

3613 Views

Last post by forsdan
Mon May 24, 2010 2:48 pm
Fermi energy

Last post by phuongvlpt « Sun May 23, 2010 3:42 pm
Replies: 6
by phuongvlpt » Fri May 07, 2010 8:31 am

6 Replies

2737 Views

Last post by phuongvlpt
Sun May 23, 2010 3:42 pm
K-Point Convergence for Surface Slab.

Last post by alex « Sat May 22, 2010 9:42 am
Replies: 1
by Sharani » Fri May 21, 2010 4:02 pm

1 Replies

2442 Views

Last post by alex
Sat May 22, 2010 9:42 am
decomposed charge density

Last post by Danny « Wed May 19, 2010 7:26 am
Replies: 1
by prlogan » Wed May 12, 2010 10:17 pm

1 Replies

2057 Views

Last post by Danny
Wed May 19, 2010 7:26 am
DYNMAT and hessian matrix

Last post by Danny « Wed May 19, 2010 7:12 am
Replies: 8
by Danny » Tue May 04, 2010 1:01 pm

8 Replies

8647 Views

Last post by Danny
Wed May 19, 2010 7:12 am
Please... help.. me

Last post by panda « Mon May 17, 2010 1:35 pm
Replies: 1
by jjkim » Sun May 16, 2010 11:58 pm

1 Replies

1138 Views

Last post by panda
Mon May 17, 2010 1:35 pm
A basic question about unitcell

Last post by jjkim « Sun May 16, 2010 10:39 am
Replies: 2
by jjkim » Sun May 16, 2010 7:32 am

2 Replies

1410 Views

Last post by jjkim
Sun May 16, 2010 10:39 am
Regarding spin-orbit calculation

Last post by jkg001 « Thu May 13, 2010 4:58 pm
Replies: 1
by soumendu » Tue Aug 05, 2008 11:25 am

1 Replies

2871 Views

Last post by jkg001
Thu May 13, 2010 4:58 pm
Total local potential

Last post by apple « Wed May 12, 2010 9:15 pm
Replies: 2
by apple » Wed May 12, 2010 7:48 pm

2 Replies

3473 Views

Last post by apple
Wed May 12, 2010 9:15 pm
Why there is "d" orbital for Carbon atom

Last post by forsdan « Wed May 12, 2010 11:14 am
Replies: 2
by zhuanghl » Mon May 10, 2010 3:14 pm

2 Replies

1558 Views

Last post by forsdan
Wed May 12, 2010 11:14 am
Energy difference

Last post by panda « Fri May 07, 2010 3:39 pm
Replies: 1
by guo,huaihong » Fri May 07, 2010 11:33 am

1 Replies

1313 Views

Last post by panda
Fri May 07, 2010 3:39 pm

New Topic

5410 topics

Page 207 of 271
- Jump to page:
Previous
1
…
205
206
207
208
209
…
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