Using VASP

Moderators: Global Moderator, Moderator

New Topic

5335 topics

Page 205 of 267
- Jump to page:
Previous
1
…
203
204
205
206
207
…
267
Next

Topics

Replies

Views

Last post

PAW-LDA Yb potential file

Last post by Danny « Tue Apr 27, 2010 2:25 pm
Replies: 1
by Danny » Tue Apr 27, 2010 1:27 pm

1 Replies

1396 Views

Last post by Danny
Tue Apr 27, 2010 2:25 pm
Visualize VASP output files

Last post by Danny « Tue Apr 27, 2010 1:29 pm
Replies: 1
by Rayan » Sun Apr 25, 2010 2:55 pm

1 Replies

2672 Views

Last post by Danny
Tue Apr 27, 2010 1:29 pm
Temperature during molecular dynamics

Last post by neo « Sun Apr 25, 2010 5:02 pm
Replies: 2
by neo » Sun Apr 25, 2010 11:14 am

2 Replies

4451 Views

Last post by neo
Sun Apr 25, 2010 5:02 pm
Using AM05 calculate the bandstructure facing the questions?

Last post by forsdan « Sat Apr 24, 2010 8:43 pm
Replies: 4
by VASP001 » Tue Apr 13, 2010 2:07 am

4 Replies

1809 Views

Last post by forsdan
Sat Apr 24, 2010 8:43 pm
How to calculate ionization potential and electron affinity?

Last post by tlchan « Thu Apr 22, 2010 1:35 pm
Replies: 1
by YunLi » Thu Apr 22, 2010 4:37 am

1 Replies

3368 Views

Last post by tlchan
Thu Apr 22, 2010 1:35 pm
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

1758 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

1592 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

4539 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

1910 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

4328 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

2301 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

3221 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

12566 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

4456 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

2563 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

2467 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

2495 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

1539 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

3683 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

1978 Views

Last post by rgc
Wed Apr 07, 2010 4:06 pm

New Topic

5335 topics

Page 205 of 267
- Jump to page:
Previous
1
…
203
204
205
206
207
…
267
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