Using VASP

Moderators: Global Moderator, Moderator

New Topic

5878 topics

Page 167 of 294
- Jump to page:
Previous
1
…
165
166
167
168
169
…
294
Next

Topics

Replies

Views

Last post

Phase normalization in PROCAR file

Last post by tomic « Mon Apr 11, 2016 5:31 pm
Replies: 2
by tomic » Wed Mar 30, 2016 12:16 pm

2 Replies

4367 Views

Last post by tomic
Mon Apr 11, 2016 5:31 pm
Hard to converge using an already converged WAVECAR

Last post by zhangguangping « Mon Apr 11, 2016 3:55 pm
Replies: 2
by zhangguangping » Mon Apr 11, 2016 1:56 pm

2 Replies

3698 Views

Last post by zhangguangping
Mon Apr 11, 2016 3:55 pm
convergence problem with 3d 4d transition metal

Last post by admin « Mon Apr 11, 2016 3:34 pm
Replies: 3
by ljzhang123 » Mon Mar 28, 2016 5:05 am

3 Replies

3999 Views

Last post by admin
Mon Apr 11, 2016 3:34 pm
Confused results of bader charge analysis for MnO2

Last post by admin « Mon Apr 11, 2016 11:48 am
Replies: 1
by jbliu » Sat Apr 09, 2016 4:20 pm

1 Replies

4586 Views

Last post by admin
Mon Apr 11, 2016 11:48 am
Clarification on GW method in VASP

Last post by askhetan « Fri Apr 08, 2016 2:01 pm
Replies: 4
by askhetan » Wed Mar 30, 2016 6:35 pm

4 Replies

7341 Views

Last post by askhetan
Fri Apr 08, 2016 2:01 pm
DOS calculation - which ALGO

Last post by admin « Wed Apr 06, 2016 9:46 am
Replies: 1
by fiori » Thu Mar 31, 2016 12:41 pm

1 Replies

3655 Views

Last post by admin
Wed Apr 06, 2016 9:46 am
How to analyze the running time in one ionic step?

Last post by admin « Tue Apr 05, 2016 10:52 am
Replies: 2
by byin » Thu Feb 25, 2016 5:15 pm

2 Replies

4425 Views

Last post by admin
Tue Apr 05, 2016 10:52 am
Back ground charge

Last post by admin « Fri Apr 01, 2016 12:45 pm
Replies: 1
by szvasp » Tue Mar 15, 2016 1:57 pm

1 Replies

3937 Views

Last post by admin
Fri Apr 01, 2016 12:45 pm
How to calculate the ion adsorption energy on a surface?

Last post by admin « Fri Mar 18, 2016 1:15 pm
Replies: 1
by sunsr » Fri Mar 18, 2016 7:34 am

1 Replies

4404 Views

Last post by admin
Fri Mar 18, 2016 1:15 pm
Electronic SCF fails for oxide tio2

Last post by satish2414 « Tue Mar 15, 2016 8:25 pm
Replies: 4
by satish2414 » Wed Nov 18, 2015 6:40 pm

4 Replies

4630 Views

Last post by satish2414
Tue Mar 15, 2016 8:25 pm
Problems in Fe clean surface optimization

Last post by alex « Thu Mar 10, 2016 6:28 pm
Replies: 3
by luisazofra » Tue Mar 08, 2016 4:43 pm

3 Replies

5397 Views

Last post by alex
Thu Mar 10, 2016 6:28 pm
Charge density in geometry optimization

Last post by zzhlax « Thu Mar 03, 2016 10:22 pm
Replies: 2
by zzhlax » Sun Feb 28, 2016 8:05 am

2 Replies

3418 Views

Last post by zzhlax
Thu Mar 03, 2016 10:22 pm
File format of CHGCAR in a spin-polarized calculation

Last post by admin « Tue Mar 01, 2016 1:36 pm
Replies: 1
by sjtuzhanglei » Sun Feb 14, 2016 9:02 pm

1 Replies

3794 Views

Last post by admin
Tue Mar 01, 2016 1:36 pm
Band structure after GW

Last post by admin « Tue Mar 01, 2016 11:42 am
Replies: 1
by dilnaazhikodan » Tue Feb 09, 2016 6:43 pm

1 Replies

3189 Views

Last post by admin
Tue Mar 01, 2016 11:42 am
What is EATOM means?

Last post by admin « Mon Feb 29, 2016 4:21 pm
Replies: 1
by ArtKa » Mon Feb 29, 2016 12:30 pm

1 Replies

5901 Views

Last post by admin
Mon Feb 29, 2016 4:21 pm
Metadynamics does not run, error: DYNCONSTR%%HILLS_METHOD

Last post by psriv « Fri Feb 26, 2016 1:00 pm
Replies: 2
by psriv » Thu Feb 25, 2016 2:25 pm

2 Replies

3790 Views

Last post by psriv
Fri Feb 26, 2016 1:00 pm
Charged vacancies

Last post by kambiz1983 « Sat Feb 20, 2016 11:08 am
Replies: 2
by kambiz1983 » Thu Feb 18, 2016 7:03 am

2 Replies

5392 Views

Last post by kambiz1983
Sat Feb 20, 2016 11:08 am
Charged slabs: restrict background charge to material region

Last post by admin « Thu Feb 18, 2016 2:07 pm
Replies: 1
by hat343 » Thu Feb 18, 2016 2:04 am

1 Replies

3358 Views

Last post by admin
Thu Feb 18, 2016 2:07 pm
CHGCAR structure

Last post by sjtuzhanglei « Sun Feb 14, 2016 8:54 pm
Replies: 2
by opvu » Tue May 09, 2006 4:50 pm

2 Replies

5211 Views

Last post by sjtuzhanglei
Sun Feb 14, 2016 8:54 pm
Vacuum level for G0W0

Last post by huangj3 « Fri Feb 12, 2016 12:42 am
Replies: 1
by huangj3 » Wed Feb 10, 2016 10:27 pm

1 Replies

3039 Views

Last post by huangj3
Fri Feb 12, 2016 12:42 am

New Topic

5878 topics

Page 167 of 294
- Jump to page:
Previous
1
…
165
166
167
168
169
…
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