Using VASP

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problem with total drift

Last post by support_vasp « Thu Sep 12, 2024 8:35 am
Replies: 1
by unique123 » Mon Apr 22, 2013 8:54 pm

1 Replies

3206 Views

Last post by support_vasp
Thu Sep 12, 2024 8:35 am
How to perform constant pressure simulation by using vasp5.3.3

Last post by support_vasp « Thu Sep 12, 2024 8:35 am
Replies: 1
by Jiang » Sun Jun 02, 2013 8:12 am

1 Replies

3173 Views

Last post by support_vasp
Thu Sep 12, 2024 8:35 am
spin orbital problem

Last post by support_vasp « Thu Sep 12, 2024 8:34 am
Replies: 1
by ktao » Mon Jul 23, 2012 9:01 pm

1 Replies

4142 Views

Last post by support_vasp
Thu Sep 12, 2024 8:34 am
add electric field into periodic three dimensional structure

Last post by support_vasp « Thu Sep 12, 2024 8:34 am
Replies: 1
by jinshang » Tue Jan 28, 2014 3:02 am

1 Replies

3601 Views

Last post by support_vasp
Thu Sep 12, 2024 8:34 am
Applying a finite electric field

Last post by support_vasp « Thu Sep 12, 2024 8:34 am
Replies: 1
by kor1981 » Fri Jan 24, 2014 7:36 am

1 Replies

4597 Views

Last post by support_vasp
Thu Sep 12, 2024 8:34 am
How can I apply strain?

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by Nanco » Fri Jan 24, 2014 4:20 am

1 Replies

3707 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
How can I do the calculation of optics properties with the selected energy range

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by msdeng » Tue Jan 21, 2014 1:44 pm

1 Replies

3308 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
problem on Sm potential

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by wen » Tue Jan 21, 2014 3:27 am

1 Replies

3230 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
Optimization of Organic Molecules on MoO3

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by danith » Wed Oct 17, 2012 4:54 pm

1 Replies

3346 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
order of f orbitals in DOSCAR

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by arnt » Wed Jun 08, 2011 2:02 pm

1 Replies

3567 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
polarizability (diag[e(oo)]) units

Last post by support_vasp « Thu Sep 12, 2024 8:33 am
Replies: 1
by Isabel » Mon Jul 15, 2013 3:52 pm

1 Replies

3067 Views

Last post by support_vasp
Thu Sep 12, 2024 8:33 am
ISPIN tag for nonmagnetic surface+adsorbate calculation

Last post by support_vasp « Thu Sep 12, 2024 8:32 am
Replies: 1
by googhgoo » Thu Oct 03, 2013 9:14 pm

1 Replies

3071 Views

Last post by support_vasp
Thu Sep 12, 2024 8:32 am
relaxation with constrained magnetic moments

Last post by support_vasp « Thu Sep 12, 2024 8:32 am
Replies: 1
by ipc01 » Sun Apr 24, 2011 11:36 am

1 Replies

3507 Views

Last post by support_vasp
Thu Sep 12, 2024 8:32 am
Should ?LCALCPOL? be used after scf?

Last post by support_vasp « Thu Sep 12, 2024 8:32 am
Replies: 1
by nkxirainbow » Mon Dec 05, 2011 6:23 pm

1 Replies

3441 Views

Last post by support_vasp
Thu Sep 12, 2024 8:32 am
the NBANDS in G0W0 calculation

Last post by support_vasp « Thu Sep 12, 2024 8:32 am
Replies: 1
by njuxyh » Sat Apr 07, 2012 11:00 am

1 Replies

3958 Views

Last post by support_vasp
Thu Sep 12, 2024 8:32 am
space group change

Last post by support_vasp « Thu Sep 12, 2024 8:32 am
Replies: 1
by Mayura » Thu Dec 19, 2013 2:22 pm

1 Replies

3913 Views

Last post by support_vasp
Thu Sep 12, 2024 8:32 am
potential normalization

Last post by support_vasp « Thu Sep 12, 2024 8:31 am
Replies: 1
by wline » Wed Dec 18, 2013 5:01 pm

1 Replies

3332 Views

Last post by support_vasp
Thu Sep 12, 2024 8:31 am
MBJLDA band structure calculation

Last post by support_vasp « Thu Sep 12, 2024 8:31 am
Replies: 1
by wyxsdu » Tue Dec 17, 2013 11:13 am

1 Replies

3586 Views

Last post by support_vasp
Thu Sep 12, 2024 8:31 am
about paw and linear_optics.

Last post by support_vasp « Thu Sep 12, 2024 8:31 am
Replies: 1
by talenth1 » Tue Dec 17, 2013 10:24 am

1 Replies

3429 Views

Last post by support_vasp
Thu Sep 12, 2024 8:31 am
Symmetrized and not symmetrized hessian

Last post by support_vasp « Thu Sep 12, 2024 8:31 am
Replies: 1
by abalone » Mon Dec 16, 2013 1:56 pm

1 Replies

3546 Views

Last post by support_vasp
Thu Sep 12, 2024 8:31 am

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