Using VASP

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VASP-CASTEP Optics Discrepancy

Last post by support_vasp « Thu Sep 12, 2024 8:44 am
Replies: 1
by robsimps » Wed Dec 19, 2012 4:05 am

1 Replies

2269 Views

Last post by support_vasp
Thu Sep 12, 2024 8:44 am
elastic constants c11,c12,c44

Last post by support_vasp « Thu Sep 12, 2024 8:44 am
Replies: 1
by lina » Mon Apr 28, 2014 6:41 pm

1 Replies

2047 Views

Last post by support_vasp
Thu Sep 12, 2024 8:44 am
how to obtain the planar/microscrope charge density/potential

Last post by support_vasp « Thu Sep 12, 2024 8:44 am
Replies: 1
by caocao » Sat Oct 15, 2011 7:58 am

1 Replies

1722 Views

Last post by support_vasp
Thu Sep 12, 2024 8:44 am
Organic Molecule On Crystal...

Last post by support_vasp « Thu Sep 12, 2024 8:44 am
Replies: 1
by danith » Mon Oct 15, 2012 11:49 am

1 Replies

1817 Views

Last post by support_vasp
Thu Sep 12, 2024 8:44 am
spin polarization

Last post by support_vasp « Thu Sep 12, 2024 8:44 am
Replies: 1
by Leny » Sat Nov 22, 2014 2:30 am

1 Replies

1792 Views

Last post by support_vasp
Thu Sep 12, 2024 8:44 am
Spin-orbit and GW

Last post by support_vasp « Thu Sep 12, 2024 8:43 am
Replies: 1
by ashwin » Mon Mar 26, 2012 6:52 pm

1 Replies

2326 Views

Last post by support_vasp
Thu Sep 12, 2024 8:43 am
spin polarised calculation with HSE

Last post by support_vasp « Thu Sep 12, 2024 8:43 am
Replies: 1
by chandrima » Tue Apr 19, 2011 2:13 am

1 Replies

1957 Views

Last post by support_vasp
Thu Sep 12, 2024 8:43 am
Unknown magnetic ground state

Last post by support_vasp « Thu Sep 12, 2024 8:43 am
Replies: 1
by szvasp » Wed Nov 05, 2014 8:04 pm

1 Replies

1948 Views

Last post by support_vasp
Thu Sep 12, 2024 8:43 am
Lattice vectors for rhombohedral cell of BiFeO3

Last post by support_vasp « Thu Sep 12, 2024 8:42 am
Replies: 1
by Iyyapparajan » Wed Nov 05, 2014 1:46 pm

1 Replies

1864 Views

Last post by support_vasp
Thu Sep 12, 2024 8:42 am
linear response and arbitrary q-points

Last post by support_vasp « Thu Sep 12, 2024 8:42 am
Replies: 1
by sam2014 » Wed Nov 05, 2014 3:19 pm

1 Replies

1850 Views

Last post by support_vasp
Thu Sep 12, 2024 8:42 am
Somebody Could send me the different input file...

Last post by support_vasp « Thu Sep 12, 2024 8:42 am
Replies: 1
by rezorva » Wed Jan 04, 2012 1:35 pm

1 Replies

1831 Views

Last post by support_vasp
Thu Sep 12, 2024 8:42 am
How to calculate planar average charge density

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by aofphy » Mon Sep 15, 2014 5:50 am

1 Replies

2400 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
Ferroelctric Polarization Calculation by DFPT or Berry Phase

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by poorvasingh » Wed Oct 15, 2014 6:45 am

1 Replies

2079 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
vasp

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by Leny » Tue Oct 14, 2014 2:59 pm

1 Replies

1654 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
Work Function, Alpha+beta Term and XC:(G=0)

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by cappri » Tue Oct 14, 2014 1:19 pm

1 Replies

2772 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
Absorption spectra plotting with vasp

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by kalpna » Thu Oct 09, 2014 7:14 pm

1 Replies

2330 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
own-VASP dimer-method vs VTST dimer-method (test)

Last post by support_vasp « Thu Sep 12, 2024 8:41 am
Replies: 1
by perez2013 » Thu Oct 02, 2014 8:15 pm

1 Replies

4592 Views

Last post by support_vasp
Thu Sep 12, 2024 8:41 am
large total drift

Last post by support_vasp « Thu Sep 12, 2024 8:40 am
Replies: 1
by rudolf.sykora » Wed Oct 01, 2014 2:10 pm

1 Replies

1882 Views

Last post by support_vasp
Thu Sep 12, 2024 8:40 am
slab LOCPOT figure sees slope in both bulk and vacuum region

Last post by support_vasp « Thu Sep 12, 2024 8:40 am
Replies: 1
by terencelz » Thu Oct 02, 2014 5:30 am

1 Replies

2212 Views

Last post by support_vasp
Thu Sep 12, 2024 8:40 am
Difference of POTCAR files between v4.6 and v5.2

Last post by support_vasp « Thu Sep 12, 2024 8:40 am
Replies: 1
by icefire » Thu Jul 24, 2014 2:29 pm

1 Replies

1541 Views

Last post by support_vasp
Thu Sep 12, 2024 8:40 am

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