Using VASP

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Suspicious energy and eigenvalue for complex-valued wavefunction

Last post by support_vasp « Wed Sep 11, 2024 1:54 pm
Replies: 1
by zhouf » Tue Dec 23, 2008 9:01 pm

1 Replies

1326 Views

Last post by support_vasp
Wed Sep 11, 2024 1:54 pm
Lande' g-factor

Last post by support_vasp « Wed Sep 11, 2024 1:54 pm
Replies: 1
by igor » Thu May 24, 2007 7:31 am

1 Replies

2369 Views

Last post by support_vasp
Wed Sep 11, 2024 1:54 pm
enthalpy versus pressure

Last post by support_vasp « Wed Sep 11, 2024 1:54 pm
Replies: 1
by linhe19802003 » Tue Dec 23, 2008 7:22 am

1 Replies

1418 Views

Last post by support_vasp
Wed Sep 11, 2024 1:54 pm
including electric dipole field in the calculation

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by puspamitra » Tue Nov 11, 2008 8:24 pm

1 Replies

1426 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
Wurtzite structure help

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by dwan » Sun Nov 09, 2008 8:34 pm

1 Replies

2569 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
WARNING: grid for Broyden might be to small

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by hlzya » Fri Nov 07, 2008 11:20 pm

1 Replies

1884 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
calculation for solution phase

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by mzzhou » Sun Nov 02, 2008 5:33 am

1 Replies

1252 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
very slow electronic convergence for FeCrNi

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by peterklaver » Thu Oct 30, 2008 2:45 pm

1 Replies

1831 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
Manipulating spin-orbit coupling

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by magal » Mon Oct 27, 2008 2:59 pm

1 Replies

1455 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
LAPACK: Routine ZPOTRF failed!

Last post by support_vasp « Wed Sep 11, 2024 1:49 pm
Replies: 1
by okuno » Mon Oct 27, 2008 2:23 pm

1 Replies

1617 Views

Last post by support_vasp
Wed Sep 11, 2024 1:49 pm
Having a question about the PAW potential

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by MDrizzle » Mon Oct 27, 2008 1:00 am

1 Replies

1313 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
What means th LUDCMP?

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by chlee » Wed Oct 15, 2008 9:53 pm

1 Replies

1876 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
Partial Hydrogen

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by jebickel » Wed Oct 15, 2008 3:44 pm

1 Replies

1330 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
Symmetry broken

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by aquleo » Thu Oct 02, 2008 7:35 am

1 Replies

1539 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
trouble about spin-polarized structure relaxation calculation under electric field.

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by nus11 » Thu Oct 02, 2008 12:25 am

1 Replies

2550 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
PDOS of Local axis

Last post by support_vasp « Wed Sep 11, 2024 1:48 pm
Replies: 1
by TMAC » Sat Sep 27, 2008 2:36 pm

1 Replies

1620 Views

Last post by support_vasp
Wed Sep 11, 2024 1:48 pm
Total magnetization after restart ...

Last post by support_vasp « Wed Sep 11, 2024 1:47 pm
Replies: 1
by icymist » Fri Sep 19, 2008 2:31 pm

1 Replies

1379 Views

Last post by support_vasp
Wed Sep 11, 2024 1:47 pm
pressure

Last post by support_vasp « Wed Sep 11, 2024 1:47 pm
Replies: 1
by chemical02 » Wed Sep 17, 2008 7:36 pm

1 Replies

1355 Views

Last post by support_vasp
Wed Sep 11, 2024 1:47 pm
Breaking of solvent molecules

Last post by support_vasp « Wed Sep 11, 2024 1:47 pm
Replies: 1
by helvetico » Wed Sep 17, 2008 2:35 pm

1 Replies

1595 Views

Last post by support_vasp
Wed Sep 11, 2024 1:47 pm
Ion charge

Last post by support_vasp « Wed Sep 11, 2024 1:47 pm
Replies: 1
by wcwang » Sun Sep 14, 2008 7:01 pm

1 Replies

1411 Views

Last post by support_vasp
Wed Sep 11, 2024 1:47 pm

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