Using VASP

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steps of bulk calculation to determine the optimized parameters

Last post by support_vasp « Wed Sep 11, 2024 2:22 pm
Replies: 1
by gump_813 » Sun Mar 08, 2009 8:35 am

1 Replies

3079 Views

Last post by support_vasp
Wed Sep 11, 2024 2:22 pm
Core Level Shifts / XPS -- experience with quaility of results?

Last post by support_vasp « Wed Sep 11, 2024 2:22 pm
Replies: 1
by janh » Mon Dec 01, 2008 6:36 pm

1 Replies

3529 Views

Last post by support_vasp
Wed Sep 11, 2024 2:22 pm
Macroscopic polarization calculation (LCALCPOL = .TRUE.)

Last post by support_vasp « Wed Sep 11, 2024 2:21 pm
Replies: 1
by ynwu » Wed Aug 04, 2010 6:34 pm

1 Replies

3671 Views

Last post by support_vasp
Wed Sep 11, 2024 2:21 pm
outcar file in NEB calculations

Last post by support_vasp « Wed Sep 11, 2024 2:21 pm
Replies: 1
by castella » Mon Aug 02, 2010 6:34 pm

1 Replies

3696 Views

Last post by support_vasp
Wed Sep 11, 2024 2:21 pm
convergence problem

Last post by support_vasp « Wed Sep 11, 2024 2:21 pm
Replies: 1
by zhu » Sun Aug 01, 2010 10:59 am

1 Replies

2750 Views

Last post by support_vasp
Wed Sep 11, 2024 2:21 pm
Effect of External Electric Field on Equilibrium Geometries and Dissociation Barriers.

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by Sharani » Thu Jul 29, 2010 7:06 pm

1 Replies

2989 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
About PCDAT?

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by xfh00 » Thu Jul 29, 2010 3:53 am

1 Replies

3097 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
I have a question about DOSCAR file

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by sonandok » Thu Jul 29, 2010 2:32 am

1 Replies

3021 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
how to get spin information in parcharge file?

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by ntuxi » Wed Jul 28, 2010 8:49 am

1 Replies

3118 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
Dielectric matrix and LDA+U

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by Piekarz » Sat Jun 05, 2010 1:08 pm

1 Replies

3051 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
problems with the convergence of Pt atom

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by saubanere » Fri Jun 04, 2010 4:52 pm

1 Replies

2786 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
about FERWE and FERDO

Last post by support_vasp « Wed Sep 11, 2024 2:20 pm
Replies: 1
by beyza » Mon Jul 26, 2010 12:52 pm

1 Replies

3319 Views

Last post by support_vasp
Wed Sep 11, 2024 2:20 pm
About the EDIFFG-tag

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by fzcsydl » Sat Jul 24, 2010 5:08 am

1 Replies

3295 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
Optical Properties in selected energy range

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by monazam » Fri Jul 23, 2010 9:59 am

1 Replies

2826 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
NELECT and charging

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by metosa » Thu Mar 25, 2010 8:34 am

1 Replies

3374 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
Possible to add external force to cluster molecular dynamics calculation?

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by hess8 » Tue May 25, 2010 5:09 pm

1 Replies

2915 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
How to visualize vibrations of VASP calculations?

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by sling » Tue May 25, 2010 3:45 pm

1 Replies

3619 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
Using VASP to calculate the properties of the optics.

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by VASP001 » Thu May 20, 2010 4:38 pm

1 Replies

3867 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
VASP 4.6.35 - Symmetry Error

Last post by support_vasp « Wed Sep 11, 2024 2:19 pm
Replies: 1
by muthukumar2k3 » Wed Jun 23, 2010 4:20 pm

1 Replies

2344 Views

Last post by support_vasp
Wed Sep 11, 2024 2:19 pm
About MAE

Last post by support_vasp « Wed Sep 11, 2024 2:18 pm
Replies: 1
by vasp16888 » Tue May 18, 2010 11:24 pm

1 Replies

4154 Views

Last post by support_vasp
Wed Sep 11, 2024 2:18 pm

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