Using VASP

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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

969 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

903 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

1071 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

1285 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

1214 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

1006 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

1350 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

843 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

908 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am
sign of wavefunction at gamma point

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by xamnidar » Sat Mar 09, 2013 9:55 pm

1 Replies

914 Views

Last post by support_vasp
Thu Sep 12, 2024 7:29 am
Free atom electronic convergence with MetaGGA

Last post by support_vasp « Thu Sep 12, 2024 7:29 am
Replies: 1
by mbkumar » Fri Feb 21, 2014 12:23 am

1 Replies

992 Views

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

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by apple » Wed Aug 01, 2012 9:02 pm

1 Replies

1001 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
The convergence is reached, but the calculation still goes on

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by anoop » Thu Feb 20, 2014 6:31 pm

1 Replies

981 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
How to calculate the free energy of isolated molecule under certain pressure

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by Mingtao » Sun Mar 10, 2013 10:31 pm

1 Replies

1070 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
Adsorption energy with vdW-DF2 method (vasp.5.2.12)

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by akuritu » Sun Jun 09, 2013 6:49 am

1 Replies

1623 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
WARNING: Sub-Space-Matrix is not hermitian in DAV in VASP 5.2

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by SchrodingersCat » Mon Jun 18, 2012 3:36 pm

1 Replies

1764 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
GW calculation, energy bands compared with PBE

Last post by support_vasp « Thu Sep 12, 2024 7:28 am
Replies: 1
by hosfa » Sat Jun 08, 2013 1:34 pm

1 Replies

1062 Views

Last post by support_vasp
Thu Sep 12, 2024 7:28 am
Applying magnetic field in VASP

Last post by support_vasp « Thu Sep 12, 2024 7:27 am
Replies: 1
by urmi » Fri Sep 06, 2013 12:55 am

1 Replies

1448 Views

Last post by support_vasp
Thu Sep 12, 2024 7:27 am
about full pressure

Last post by support_vasp « Thu Sep 12, 2024 7:27 am
Replies: 1
by slava_0812 » Tue Jun 19, 2012 10:12 am

1 Replies

994 Views

Last post by support_vasp
Thu Sep 12, 2024 7:27 am
A topological insulator thin film in an electric field

Last post by support_vasp « Thu Sep 12, 2024 7:27 am
Replies: 1
by paulfons » Tue Nov 26, 2013 10:45 am

1 Replies

1660 Views

Last post by support_vasp
Thu Sep 12, 2024 7:27 am

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