Using VASP

Moderators: Global Moderator, Moderator

New Topic

5318 topics

Page 199 of 266
- Jump to page:
Previous
1
…
197
198
199
200
201
…
266
Next

Topics

Replies

Views

Last post

Access to P4VASP

Last post by metosa « Tue Aug 31, 2010 9:37 am
Replies: 1
by munvasp » Mon Aug 30, 2010 4:10 pm

1 Replies

1131 Views

Last post by metosa
Tue Aug 31, 2010 9:37 am
How to calculate the vibrational entropy of a certain substance at some temperature?

Last post by forsdan « Tue Aug 31, 2010 9:20 am
Replies: 3
by tssunrise » Mon Aug 30, 2010 2:37 am

3 Replies

4468 Views

Last post by forsdan
Tue Aug 31, 2010 9:20 am
convergence problem using VASP 5.2

Last post by zhu « Tue Aug 31, 2010 4:27 am
Replies: 1
by zhu » Mon Aug 30, 2010 1:00 am

1 Replies

936 Views

Last post by zhu
Tue Aug 31, 2010 4:27 am
DFT+U

Last post by apple « Mon Aug 30, 2010 4:41 pm
Replies: 2
by apple » Mon Aug 30, 2010 12:21 am

2 Replies

1415 Views

Last post by apple
Mon Aug 30, 2010 4:41 pm
MD determin the structure

Last post by vasp16888 « Mon Aug 30, 2010 8:59 am
Replies: 2
by vasp16888 » Wed Aug 11, 2010 8:49 am

2 Replies

2090 Views

Last post by vasp16888
Mon Aug 30, 2010 8:59 am
EIGENVAL file kpoint coordinates not matching KPOINTS file

Last post by lyon0100 « Sun Aug 29, 2010 9:45 pm
Replies: 1
by lyon0100 » Sat Aug 28, 2010 8:51 am

1 Replies

2551 Views

Last post by lyon0100
Sun Aug 29, 2010 9:45 pm
one question about 'Pstress'

Last post by enya « Sun Aug 29, 2010 6:10 pm
Replies: 1
by zyang » Sat Aug 28, 2010 10:16 pm

1 Replies

1865 Views

Last post by enya
Sun Aug 29, 2010 6:10 pm
How to find Band GAp when there is fractional occupancy

Last post by metosa « Sat Aug 28, 2010 6:14 pm
Replies: 1
by omkar.nene » Sat Aug 28, 2010 12:20 pm

1 Replies

1571 Views

Last post by metosa
Sat Aug 28, 2010 6:14 pm
Atomic relaxations in cartesian

Last post by metosa « Fri Aug 27, 2010 2:53 am
Replies: 2
by sergio » Thu Aug 26, 2010 7:04 pm

2 Replies

2061 Views

Last post by metosa
Fri Aug 27, 2010 2:53 am
Dipole correction for slabs

Last post by admin « Thu Aug 26, 2010 2:50 pm
Replies: 1
by giacomo giorgi » Wed Aug 04, 2010 10:39 am

1 Replies

5240 Views

Last post by admin
Thu Aug 26, 2010 2:50 pm
how to get frequency dependent dilectric constant

Last post by admin « Thu Aug 26, 2010 2:43 pm
Replies: 1
by hpaudel » Wed Aug 04, 2010 11:12 pm

1 Replies

1726 Views

Last post by admin
Thu Aug 26, 2010 2:43 pm
View input files?

Last post by metosa « Thu Aug 26, 2010 8:37 am
Replies: 3
by snk13 » Wed Aug 25, 2010 5:55 pm

3 Replies

2900 Views

Last post by metosa
Thu Aug 26, 2010 8:37 am
error reading LOPCOT file

Last post by metosa « Tue Aug 24, 2010 3:14 pm
Replies: 1
by dinhloc1984 » Thu Aug 19, 2010 6:59 am

1 Replies

2024 Views

Last post by metosa
Tue Aug 24, 2010 3:14 pm
partial optimization

Last post by forsdan « Sat Aug 21, 2010 10:28 am
Replies: 1
by giacomo giorgi » Fri Aug 20, 2010 3:26 am

1 Replies

1182 Views

Last post by forsdan
Sat Aug 21, 2010 10:28 am
initial density matrix for LDA+U

Last post by boris « Fri Aug 20, 2010 11:24 am
Replies: 1
by alex1981 » Thu Aug 19, 2010 11:21 pm

1 Replies

1229 Views

Last post by boris
Fri Aug 20, 2010 11:24 am
nagtive value CHGCAR file

Last post by hanyuhonest « Sun Aug 15, 2010 3:49 pm
Replies: 4
by hanyuhonest » Sat Aug 14, 2010 12:19 pm

4 Replies

1971 Views

Last post by hanyuhonest
Sun Aug 15, 2010 3:49 pm
CHGCAR file

Last post by hanyuhonest « Sat Aug 14, 2010 11:53 am
Replies: 4
by beyza » Tue Jul 13, 2010 9:36 am

4 Replies

2604 Views

Last post by hanyuhonest
Sat Aug 14, 2010 11:53 am
How to differentiate Raman and Infrared in VASP phonon calculation?

Last post by alex « Wed Aug 11, 2010 9:24 am
Replies: 5
by lisakite99 » Thu Jul 08, 2010 5:45 pm

5 Replies

8031 Views

Last post by alex
Wed Aug 11, 2010 9:24 am
How to plot the ELF figure?

Last post by imcnab « Sat Aug 07, 2010 10:55 pm
Replies: 3
by rzhuang » Thu Sep 25, 2008 2:59 am

3 Replies

3394 Views

Last post by imcnab
Sat Aug 07, 2010 10:55 pm
Is it possible to apply an external electric field in a diagonal direction?

Last post by forsdan « Sat Aug 07, 2010 11:11 am
Replies: 1
by sigi14 » Fri Aug 06, 2010 10:36 pm

1 Replies

1182 Views

Last post by forsdan
Sat Aug 07, 2010 11:11 am

New Topic

5318 topics

Page 199 of 266
- Jump to page:
Previous
1
…
197
198
199
200
201
…
266
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