Using VASP

Moderators: Global Moderator, Moderator

New Topic

5883 topics

Page 223 of 295
- Jump to page:
Previous
1
…
221
222
223
224
225
…
295
Next

Topics

Replies

Views

Last post

how to calculate EXX and correlation energy with RPA

Last post by zhuanghl « Fri Dec 17, 2010 7:41 am
Replies: 1
by yuxiao_zihan » Sun Sep 19, 2010 6:57 am

1 Replies

3754 Views

Last post by zhuanghl
Fri Dec 17, 2010 7:41 am
Problem about the softwares plops .

Last post by kirsten « Tue Dec 14, 2010 10:36 am
Replies: 4
by VASP001 » Mon Jun 07, 2010 1:37 am

4 Replies

6378 Views

Last post by kirsten
Tue Dec 14, 2010 10:36 am
PROCAR problem

Last post by physicalattraction « Tue Dec 14, 2010 8:19 am
Replies: 1
by liuhuimeiwoo » Tue Nov 23, 2010 3:02 am

1 Replies

4117 Views

Last post by physicalattraction
Tue Dec 14, 2010 8:19 am
How can we calculate Polarization and vibrational frequency using vasp?

Last post by metosa « Wed Dec 08, 2010 8:19 pm
Replies: 1
by Isha » Tue Dec 07, 2010 12:54 pm

1 Replies

3278 Views

Last post by metosa
Wed Dec 08, 2010 8:19 pm
Germanium's Band Structure

Last post by metosa « Tue Dec 07, 2010 7:18 pm
Replies: 4
by hat343 » Mon Dec 06, 2010 6:23 pm

4 Replies

6281 Views

Last post by metosa
Tue Dec 07, 2010 7:18 pm
Help with the symmetry and type of cell

Last post by alex « Tue Dec 07, 2010 8:47 am
Replies: 1
by kmkumar » Mon Dec 06, 2010 5:14 pm

1 Replies

3686 Views

Last post by alex
Tue Dec 07, 2010 8:47 am
selective optimization of cell vectors

Last post by forsdan « Sat Dec 04, 2010 9:36 pm
Replies: 1
by ashwin » Sat Dec 04, 2010 5:36 pm

1 Replies

7604 Views

Last post by forsdan
Sat Dec 04, 2010 9:36 pm
Simple question about KPOINT grids

Last post by metosa « Fri Dec 03, 2010 2:13 pm
Replies: 1
by discoduck » Fri Dec 03, 2010 10:22 am

1 Replies

3068 Views

Last post by metosa
Fri Dec 03, 2010 2:13 pm
Interlayer distance of bilayer graphene

Last post by dinhloc1984 « Fri Dec 03, 2010 12:47 am
Replies: 2
by dinhloc1984 » Thu Dec 02, 2010 2:29 pm

2 Replies

4978 Views

Last post by dinhloc1984
Fri Dec 03, 2010 12:47 am
Mesh parameter in the KPOINTS - file

Last post by metosa « Thu Dec 02, 2010 3:48 pm
Replies: 1
by serenade25 » Thu Dec 02, 2010 12:56 pm

1 Replies

3395 Views

Last post by metosa
Thu Dec 02, 2010 3:48 pm
About ZHEGV failed

Last post by jlbettis « Mon Nov 29, 2010 5:43 am
Replies: 6
by gabral » Tue Dec 13, 2005 8:17 am

6 Replies

8392 Views

Last post by jlbettis
Mon Nov 29, 2010 5:43 am
GWA in vasp5.2.8

Last post by metosa « Sun Nov 28, 2010 4:47 am
Replies: 5
by sdwang » Sat Nov 20, 2010 11:01 am

5 Replies

6187 Views

Last post by metosa
Sun Nov 28, 2010 4:47 am
VASP GW with Silicon

Last post by tilak « Wed Nov 24, 2010 5:18 pm
Replies: 1
by Redorb » Tue Nov 16, 2010 11:57 pm

1 Replies

4322 Views

Last post by tilak
Wed Nov 24, 2010 5:18 pm
HF calculations: internal error, the gradient is not orthogonal

Last post by wuli8 « Wed Nov 24, 2010 11:24 am
Replies: 1
by koriro » Fri Nov 19, 2010 5:37 am

1 Replies

5924 Views

Last post by wuli8
Wed Nov 24, 2010 11:24 am
Carbon nano tube

Last post by farzaneh « Wed Nov 24, 2010 8:06 am
Replies: 2
by farzaneh » Wed Nov 24, 2010 5:18 am

2 Replies

3429 Views

Last post by farzaneh
Wed Nov 24, 2010 8:06 am
Calculation of spontaneous polarization using vasp 5.2

Last post by happyer225 « Tue Nov 23, 2010 12:52 am
Replies: 5
by Amritendu » Thu Aug 26, 2010 1:54 pm

5 Replies

10896 Views

Last post by happyer225
Tue Nov 23, 2010 12:52 am
electron number by integral the DOSCAR

Last post by physicalattraction « Fri Nov 19, 2010 9:36 am
Replies: 1
by xfh00 » Thu Nov 11, 2010 12:13 am

1 Replies

3352 Views

Last post by physicalattraction
Fri Nov 19, 2010 9:36 am
Question on the unit when simulating with the electric field...

Last post by Sonny « Fri Nov 19, 2010 8:32 am
Replies: 1
by yuyaolun » Thu Nov 11, 2010 3:19 am

1 Replies

3922 Views

Last post by Sonny
Fri Nov 19, 2010 8:32 am
symmetry warning in HSE jobs

Last post by alex « Thu Nov 18, 2010 7:33 am
Replies: 3
by apple » Wed Nov 17, 2010 12:13 am

3 Replies

6375 Views

Last post by alex
Thu Nov 18, 2010 7:33 am
HSE calculations-details

Last post by apple « Mon Nov 15, 2010 12:51 am
Replies: 3
by apple » Tue Nov 02, 2010 4:50 pm

3 Replies

4838 Views

Last post by apple
Mon Nov 15, 2010 12:51 am

New Topic

5883 topics

Page 223 of 295
- Jump to page:
Previous
1
…
221
222
223
224
225
…
295
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