Using VASP

Moderators: Global Moderator, Moderator

New Topic

5410 topics

Page 209 of 271
- Jump to page:
Previous
1
…
207
208
209
210
211
…
271
Next

Topics

Replies

Views

Last post

How to set the RWIGS tag in INCAR??

Last post by amul1umt « Wed Apr 21, 2010 8:30 pm
Replies: 2
by wfei » Thu Apr 20, 2006 1:26 pm

2 Replies

1858 Views

Last post by amul1umt
Wed Apr 21, 2010 8:30 pm
DOS/PDOS stuck at "Maximum index for non-local projection operator"

Last post by bkappes « Wed Apr 21, 2010 4:12 pm
Replies: 1
by bkappes » Mon Apr 19, 2010 2:28 pm

1 Replies

1702 Views

Last post by bkappes
Wed Apr 21, 2010 4:12 pm
projected bands

Last post by giacomo giorgi « Wed Apr 21, 2010 12:04 pm
Replies: 9
by giacomo giorgi » Wed Apr 14, 2010 3:21 pm

9 Replies

4735 Views

Last post by giacomo giorgi
Wed Apr 21, 2010 12:04 pm
Structural optimisation of CNT (13,0)

Last post by mikeb86 « Wed Apr 21, 2010 10:12 am
Replies: 3
by mikeb86 » Thu Apr 15, 2010 10:06 am

3 Replies

2045 Views

Last post by mikeb86
Wed Apr 21, 2010 10:12 am
LDA+U, Spin-Orbit Coupling and Orbital Moment

Last post by boris « Tue Apr 20, 2010 5:38 pm
Replies: 6
by boris » Fri Apr 16, 2010 12:55 pm

6 Replies

4505 Views

Last post by boris
Tue Apr 20, 2010 5:38 pm
anti-ferromagnetism

Last post by apple « Sat Apr 17, 2010 5:44 pm
Replies: 2
by apple » Sat Apr 17, 2010 2:59 pm

2 Replies

2438 Views

Last post by apple
Sat Apr 17, 2010 5:44 pm
DIPOLE MOMENT for a vacuum molecule

Last post by Eduard « Thu Apr 15, 2010 10:16 am
Replies: 1
by Eduard » Fri Dec 18, 2009 4:12 pm

1 Replies

3331 Views

Last post by Eduard
Thu Apr 15, 2010 10:16 am
H2 dissociation energy

Last post by admin « Thu Apr 15, 2010 9:51 am
Replies: 13
by pavel » Tue Sep 25, 2007 2:45 pm

13 Replies

13012 Views

Last post by admin
Thu Apr 15, 2010 9:51 am
EFIELD unit

Last post by yjwang « Wed Apr 14, 2010 2:26 pm
Replies: 3
by zlch5 » Thu Mar 09, 2006 10:43 pm

3 Replies

4687 Views

Last post by yjwang
Wed Apr 14, 2010 2:26 pm
How can I get "STRUCTURE FACTOR" from MD simulation?

Last post by maryam « Wed Apr 14, 2010 7:41 am
Replies: 2
by maryam » Mon Apr 12, 2010 12:24 pm

2 Replies

2681 Views

Last post by maryam
Wed Apr 14, 2010 7:41 am
How to optimize AMIX_MAG and BMIX_MAG

Last post by JohnnyTsien « Mon Apr 12, 2010 2:48 pm
Replies: 2
by JohnnyTsien » Sun Apr 11, 2010 3:15 am

2 Replies

2620 Views

Last post by JohnnyTsien
Mon Apr 12, 2010 2:48 pm
charge state of defect

Last post by admin « Mon Apr 12, 2010 10:34 am
Replies: 1
by zhu » Mon Apr 12, 2010 9:40 am

1 Replies

2604 Views

Last post by admin
Mon Apr 12, 2010 10:34 am
How many cpus are needed

Last post by panda « Thu Apr 08, 2010 1:51 pm
Replies: 3
by zhuanghl » Sun Apr 04, 2010 6:21 am

3 Replies

1680 Views

Last post by panda
Thu Apr 08, 2010 1:51 pm
How to get metal oxide slab converge to specific AFM configuration

Last post by JohnnyTsien « Thu Apr 08, 2010 2:54 am
Replies: 5
by JohnnyTsien » Wed Apr 07, 2010 6:46 am

5 Replies

3858 Views

Last post by JohnnyTsien
Thu Apr 08, 2010 2:54 am
VWN and magnetic systems with PBE

Last post by rgc « Wed Apr 07, 2010 4:06 pm
Replies: 2
by rgc » Wed Apr 07, 2010 2:05 pm

2 Replies

2117 Views

Last post by rgc
Wed Apr 07, 2010 4:06 pm
thermal expansion calculated with VASP

Last post by forsdan « Tue Apr 06, 2010 2:56 pm
Replies: 1
by Danny » Tue Apr 06, 2010 2:23 pm

1 Replies

2900 Views

Last post by forsdan
Tue Apr 06, 2010 2:56 pm
HSE xc error: internal error, the gradient is not orthogonal

Last post by VASP001 « Fri Apr 02, 2010 2:09 pm
Replies: 1
by ynwu » Mon Feb 15, 2010 5:53 am

1 Replies

3965 Views

Last post by VASP001
Fri Apr 02, 2010 2:09 pm
CONTCAR format changed in VASP 5.X?

Last post by Danny « Fri Apr 02, 2010 10:46 am
Replies: 2
by Danny » Fri Apr 02, 2010 9:12 am

2 Replies

1386 Views

Last post by Danny
Fri Apr 02, 2010 10:46 am
How to set smass parameter when doing MD calculation

Last post by fanghz « Fri Apr 02, 2010 8:30 am
Replies: 2
by fanghz » Fri Apr 02, 2010 2:41 am

2 Replies

2460 Views

Last post by fanghz
Fri Apr 02, 2010 8:30 am
Problem in Hybrid function calculation:number of k-points incorrect 14

Last post by superyoyo « Thu Apr 01, 2010 11:47 am
Replies: 2
by limaojlu » Tue Jan 05, 2010 2:03 pm

2 Replies

4682 Views

Last post by superyoyo
Thu Apr 01, 2010 11:47 am

New Topic

5410 topics

Page 209 of 271
- Jump to page:
Previous
1
…
207
208
209
210
211
…
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