Using VASP

Moderators: Global Moderator, Moderator

New Topic

5867 topics

Page 178 of 294
- Jump to page:
Previous
1
…
176
177
178
179
180
…
294
Next

Topics

Replies

Views

Last post

print out more digits in EIGENVAL or OUTPUT

Last post by admin « Tue Feb 04, 2014 6:46 pm
Replies: 1
by lawlietVASP » Wed Jan 29, 2014 2:39 am

1 Replies

2739 Views

Last post by admin
Tue Feb 04, 2014 6:46 pm
Error code was IERR=0 ... . Found N= 194 data.

Last post by admin « Tue Feb 04, 2014 6:36 pm
Replies: 1
by tilak » Mon Jan 27, 2014 9:45 am

1 Replies

5494 Views

Last post by admin
Tue Feb 04, 2014 6:36 pm
Sub-Space-Matrix is not hermitian in DAV

Last post by suddha « Tue Feb 04, 2014 12:53 pm
Replies: 2
by suddha » Thu Jan 30, 2014 4:18 pm

2 Replies

8102 Views

Last post by suddha
Tue Feb 04, 2014 12:53 pm
ISIF = 3 with some constraints

Last post by admin « Mon Feb 03, 2014 6:16 pm
Replies: 1
by kambiz » Fri Jan 31, 2014 6:00 am

1 Replies

2739 Views

Last post by admin
Mon Feb 03, 2014 6:16 pm
Core Level Shifts / XPS

Last post by metosa « Sat Feb 01, 2014 1:07 am
Replies: 2
by janh » Fri Aug 03, 2007 7:34 pm

2 Replies

11339 Views

Last post by metosa
Sat Feb 01, 2014 1:07 am
how to do back-folding of bandstructure

Last post by paume « Thu Jan 30, 2014 10:41 am
Replies: 2
by yuxiao_zihan » Thu Apr 17, 2008 10:52 am

2 Replies

4737 Views

Last post by paume
Thu Jan 30, 2014 10:41 am
How to calculate the band structure of supercell

Last post by paume « Thu Jan 30, 2014 10:26 am
Replies: 2
by chenweiguang » Mon Oct 20, 2008 10:47 am

2 Replies

7522 Views

Last post by paume
Thu Jan 30, 2014 10:26 am
Bandstructures unfolding

Last post by paume « Thu Jan 30, 2014 10:17 am
Replies: 2
by hpaudel » Wed May 09, 2012 7:26 pm

2 Replies

4102 Views

Last post by paume
Thu Jan 30, 2014 10:17 am
Brillouin-zone unfolding in VASP

Last post by paume « Thu Jan 30, 2014 10:16 am
Replies: 6
by Eugene » Tue Nov 17, 2009 2:37 am

6 Replies

7861 Views

Last post by paume
Thu Jan 30, 2014 10:16 am
unfolding of band structure

Last post by paume « Thu Jan 30, 2014 9:46 am
Replies: 2
by Lilia Woods » Wed May 15, 2013 8:04 pm

2 Replies

6422 Views

Last post by paume
Thu Jan 30, 2014 9:46 am
Bandstructure of Si in GW

Last post by Vijay@vasp « Wed Jan 29, 2014 11:35 am
Replies: 4
by liu » Wed Dec 05, 2012 7:53 am

4 Replies

5241 Views

Last post by Vijay@vasp
Wed Jan 29, 2014 11:35 am
Slab calculation

Last post by Bmodak « Wed Jan 29, 2014 7:09 am
Replies: 3
by Bmodak » Fri Jan 24, 2014 12:41 pm

3 Replies

4058 Views

Last post by Bmodak
Wed Jan 29, 2014 7:09 am
spin polarized calculation

Last post by alex « Tue Jan 28, 2014 9:46 am

by alex » Tue Jan 28, 2014 9:46 am

0 Replies

2134 Views

Last post by alex
Tue Jan 28, 2014 9:46 am
The HSE06 calculations about band structures

Last post by yanzilai « Mon Jan 27, 2014 3:57 am
Replies: 2
by yanzilai » Sun Jan 26, 2014 4:02 pm

2 Replies

3870 Views

Last post by yanzilai
Mon Jan 27, 2014 3:57 am
Abnormally High Ionic Polarization

Last post by mashton « Fri Jan 24, 2014 4:20 pm
Replies: 1
by mashton » Mon Dec 09, 2013 10:49 pm

1 Replies

2913 Views

Last post by mashton
Fri Jan 24, 2014 4:20 pm
how to calculate stabilization due to vdW when using vdW-DF?

Last post by stephan « Tue Jan 21, 2014 11:50 am
Replies: 1
by Ghorbanpour » Tue Jan 21, 2014 7:59 am

1 Replies

3393 Views

Last post by stephan
Tue Jan 21, 2014 11:50 am
about the energy calculated by vdW-DF2

Last post by lukasz.rzeznik « Mon Jan 20, 2014 5:02 pm
Replies: 1
by dwyuan » Wed Jan 08, 2014 8:00 am

1 Replies

2681 Views

Last post by lukasz.rzeznik
Mon Jan 20, 2014 5:02 pm
Constant-pressure MD Trajectory reference point

Last post by Vahid Askarpour « Mon Jan 20, 2014 2:39 pm
Replies: 1
by Vahid Askarpour » Sat Jan 18, 2014 9:59 pm

1 Replies

2639 Views

Last post by Vahid Askarpour
Mon Jan 20, 2014 2:39 pm
Positive Total energy in the calculation

Last post by admin « Mon Jan 20, 2014 11:55 am
Replies: 1
by Jaehyung » Sun Jan 19, 2014 8:46 am

1 Replies

3342 Views

Last post by admin
Mon Jan 20, 2014 11:55 am
NELEC

Last post by admin « Mon Jan 20, 2014 11:29 am
Replies: 1
by hayak » Sun Jan 19, 2014 4:04 pm

1 Replies

3250 Views

Last post by admin
Mon Jan 20, 2014 11:29 am

New Topic

5867 topics

Page 178 of 294
- Jump to page:
Previous
1
…
176
177
178
179
180
…
294
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