Using VASP

Moderators: Global Moderator, Moderator

New Topic

5419 topics

Page 147 of 271
- Jump to page:
Previous
1
…
145
146
147
148
149
…
271
Next

Topics

Replies

Views

Last post

LOCPOT from G0W0

Last post by admin « Thu Jul 23, 2015 11:45 am
Replies: 1
by nitinkr » Sun Jun 28, 2015 5:01 pm

1 Replies

1425 Views

Last post by admin
Thu Jul 23, 2015 11:45 am
Error in relaxation

Last post by admin « Wed Jul 22, 2015 2:35 pm
Replies: 1
by Samin.2 » Fri Jul 10, 2015 2:58 pm

1 Replies

1862 Views

Last post by admin
Wed Jul 22, 2015 2:35 pm
Handling memory on GW

Last post by jxzhu « Fri Jul 17, 2015 8:44 pm
Replies: 1
by sponza » Fri Jun 06, 2014 5:25 pm

1 Replies

2354 Views

Last post by jxzhu
Fri Jul 17, 2015 8:44 pm
How to extract the total energy from ACFDT-RPA calculations?

Last post by juhL « Wed Jul 15, 2015 12:52 pm
Replies: 6
by vaspGG » Sun Apr 26, 2015 11:22 am

6 Replies

4044 Views

Last post by juhL
Wed Jul 15, 2015 12:52 pm
Questions on Si band structure at Gamma point using HSE06

Last post by sunncepu « Tue Jul 07, 2015 8:54 am
Replies: 1
by sunncepu » Thu Jul 02, 2015 11:01 am

1 Replies

1667 Views

Last post by sunncepu
Tue Jul 07, 2015 8:54 am
Large value for SMASS with large value for Sigma

Last post by comorado « Tue Jun 16, 2015 8:36 pm
Replies: 2
by comorado » Thu Jun 11, 2015 10:42 pm

2 Replies

1889 Views

Last post by comorado
Tue Jun 16, 2015 8:36 pm
Magnetic moment constraints for the collinear case

Last post by tomic « Mon Jun 15, 2015 9:56 am
Replies: 4
by tomic » Thu Jun 11, 2015 3:18 pm

4 Replies

3179 Views

Last post by tomic
Mon Jun 15, 2015 9:56 am
EDDDAV Error in exact diagonalization (ALGO=Exact)

Last post by juhL « Fri Jun 12, 2015 1:54 pm
Replies: 2
by juhL » Fri Jun 12, 2015 1:04 pm

2 Replies

1969 Views

Last post by juhL
Fri Jun 12, 2015 1:54 pm
Parallel performance of VASP

Last post by suen « Thu Jun 11, 2015 4:35 pm
Replies: 2
by suen » Wed Jun 10, 2015 8:06 am

2 Replies

1620 Views

Last post by suen
Thu Jun 11, 2015 4:35 pm
Does anyone know that calculate piezoelectric constant at VA

Last post by maartendft « Wed Jun 10, 2015 8:40 pm
Replies: 3
by BERNA AKGENC » Sat Mar 21, 2015 11:52 pm

3 Replies

3385 Views

Last post by maartendft
Wed Jun 10, 2015 8:40 pm
TOTAL-FORCE all zero

Last post by yingma « Fri Jun 05, 2015 4:03 pm
Replies: 2
by yingma » Thu Jun 04, 2015 4:36 am

2 Replies

2213 Views

Last post by yingma
Fri Jun 05, 2015 4:03 pm
The error in the calculating elastic constant

Last post by admin « Fri Jun 05, 2015 1:09 pm
Replies: 1
by VASP001 » Sun May 31, 2015 4:16 am

1 Replies

2000 Views

Last post by admin
Fri Jun 05, 2015 1:09 pm
GGA tag (INCAR) and LEXCH tag (POTCAR)

Last post by suresh0807 « Tue Jun 02, 2015 3:29 pm
Replies: 2
by suresh0807 » Tue May 05, 2015 5:17 pm

2 Replies

6202 Views

Last post by suresh0807
Tue Jun 02, 2015 3:29 pm
van der Waals correction

Last post by Bmodak « Mon Jun 01, 2015 2:54 pm
Replies: 2
by Bmodak » Wed May 27, 2015 8:54 am

2 Replies

2221 Views

Last post by Bmodak
Mon Jun 01, 2015 2:54 pm
How to align the HSE and PBE average potentials

Last post by eariel99 « Thu May 21, 2015 5:13 pm

by eariel99 » Thu May 21, 2015 5:13 pm

0 Replies

1637 Views

Last post by eariel99
Thu May 21, 2015 5:13 pm
How to Calculate Inverse Participation Ratio

Last post by aruth « Mon May 18, 2015 10:15 pm

by aruth » Mon May 18, 2015 10:15 pm

0 Replies

3028 Views

Last post by aruth
Mon May 18, 2015 10:15 pm
what is wrong with vaspwiki and example page link

Last post by M Dave « Mon May 18, 2015 2:06 pm

by M Dave » Mon May 18, 2015 2:06 pm

0 Replies

1204 Views

Last post by M Dave
Mon May 18, 2015 2:06 pm
mix the charge density and density matrix separately

Last post by umklapp_sai « Thu May 14, 2015 10:20 pm

by umklapp_sai » Thu May 14, 2015 10:20 pm

0 Replies

1165 Views

Last post by umklapp_sai
Thu May 14, 2015 10:20 pm
GGA tag confusion RPBE or revPBE

Last post by suresh0807 « Tue May 12, 2015 1:11 pm
Replies: 2
by suresh0807 » Fri May 08, 2015 4:29 pm

2 Replies

4534 Views

Last post by suresh0807
Tue May 12, 2015 1:11 pm
restart for elastic tensor calculations

Last post by alex « Mon May 11, 2015 4:19 pm
Replies: 2
by gdezano » Mon May 11, 2015 9:12 am

2 Replies

1756 Views

Last post by alex
Mon May 11, 2015 4:19 pm

New Topic

5419 topics

Page 147 of 271
- Jump to page:
Previous
1
…
145
146
147
148
149
…
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