Using VASP

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printing out partial magnetization in spin-polarized hybrid calc

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by md » Thu Nov 10, 2011 3:50 pm

1 Replies

1200 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
MD for icosahedron

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by M Dave » Mon Jan 21, 2013 2:35 pm

1 Replies

1097 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
DFT+U

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by SKS » Sun Aug 04, 2013 5:35 pm

1 Replies

1184 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Cell optimization and atomic relaxation

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by Lian » Thu Apr 25, 2013 3:29 pm

1 Replies

1398 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
L(S)DA Pseudopotential

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by assari10 » Mon Mar 05, 2012 10:03 am

1 Replies

1028 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
How to print out the kinetic energy of system in a total energy calculations by VASP.

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by sfli » Thu Nov 10, 2011 6:58 pm

1 Replies

1411 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Convergence problems with EFIELD and NELECT

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by emera86 » Tue Jul 31, 2012 12:34 pm

1 Replies

1914 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Strange behavior of vdW-DF calculation

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by byhill » Fri Apr 20, 2012 3:51 pm

1 Replies

1067 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Smearing method-Tetrahedron method with bloechl corrections for metallic systems

Last post by support_vasp « Thu Sep 12, 2024 7:31 am
Replies: 1
by biswaranjandash » Fri Sep 16, 2011 4:10 am

1 Replies

1349 Views

Last post by support_vasp
Thu Sep 12, 2024 7:31 am
missing POTCARs

Last post by support_vasp « Thu Sep 12, 2024 7:31 am
Replies: 1
by uschmidt » Fri Apr 26, 2013 10:46 am

1 Replies

1183 Views

Last post by support_vasp
Thu Sep 12, 2024 7:31 am
Bond order

Last post by support_vasp « Thu Sep 12, 2024 7:31 am
Replies: 1
by kambiz » Sat Apr 21, 2012 9:14 am

1 Replies

1730 Views

Last post by support_vasp
Thu Sep 12, 2024 7:31 am
A question of physics - LOPTICS vs LEPSILON

Last post by support_vasp « Thu Sep 12, 2024 7:31 am
Replies: 1
by giacomo giorgi » Fri Mar 08, 2013 5:06 pm

1 Replies

1145 Views

Last post by support_vasp
Thu Sep 12, 2024 7:31 am
Charge density

Last post by support_vasp « Thu Sep 12, 2024 7:30 am
Replies: 1
by gawhanedhiraj » Fri Jun 07, 2013 1:53 pm

1 Replies

1051 Views

Last post by support_vasp
Thu Sep 12, 2024 7:30 am
LWAVE LCHARG tag

Last post by support_vasp « Thu Sep 12, 2024 7:30 am
Replies: 1
by sagarinphysics » Sat Jan 04, 2014 10:00 am

1 Replies

1257 Views

Last post by support_vasp
Thu Sep 12, 2024 7:30 am
number of occupied bands

Last post by support_vasp « Thu Sep 12, 2024 7:30 am
Replies: 1
by nkxirainbow » Fri Nov 11, 2011 1:00 pm

1 Replies

1447 Views

Last post by support_vasp
Thu Sep 12, 2024 7:30 am
DFT D3

Last post by support_vasp « Thu Sep 12, 2024 7:30 am
Replies: 1
by pfleura2 » Tue Aug 06, 2013 4:14 pm

1 Replies

1391 Views

Last post by support_vasp
Thu Sep 12, 2024 7:30 am
H passivation

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by apple » Tue Apr 24, 2012 5:50 pm

1 Replies

1175 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am
constant volume heat capacity

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by rwixom » Fri Nov 16, 2012 5:55 am

1 Replies

1549 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am
How to specify magnetic moments for Ferro and Ferri magnetic systems

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by naresh124 » Sun Sep 23, 2012 12:38 pm

1 Replies

1028 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am
N CORELEVELS VASP ERROR

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by blair_tuttle » Tue Aug 06, 2013 8:37 pm

1 Replies

1078 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am

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