Using VASP

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Spin-polarized calculations

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by apple » Fri Jul 23, 2010 2:51 am

1 Replies

2400 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
Optical Properties

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by hpaudel » Wed Jul 21, 2010 9:41 pm

1 Replies

3003 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
Plane wave coefficients

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by pesonkr » Wed Jul 21, 2010 6:31 am

1 Replies

2199 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
Questions about the MD

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by VASP001 » Sat May 01, 2010 6:47 pm

1 Replies

2174 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
can electrons be positive?

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by alexeyzayak » Wed Jun 02, 2010 6:01 pm

1 Replies

2057 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
LDOS and work function

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by link879 » Sat Mar 20, 2010 9:12 am

1 Replies

1909 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
PROCAR with spin-orbit

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by spakinfo » Fri Jul 16, 2010 4:20 pm

1 Replies

2486 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
Negative value in CHGCAR for Si bulk scf calculation

Last post by support_vasp « Wed Sep 11, 2024 2:24 pm
Replies: 1
by brsahu » Tue Jun 01, 2010 3:36 pm

1 Replies

2193 Views

Last post by support_vasp
Wed Sep 11, 2024 2:24 pm
working on graphene sheet using VASP

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by Isha » Thu Jul 15, 2010 9:30 am

1 Replies

1833 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
problem relaxing

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by bp249507 » Thu Apr 29, 2010 5:07 am

1 Replies

1814 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
PAW potential

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by jan » Thu Jul 31, 2008 9:38 pm

1 Replies

2757 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
I got confused about the LDA-potential

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by MDrizzle » Thu Jul 31, 2008 9:05 am

1 Replies

2274 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
How to generate the intermediate points in NEB?

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by jglee » Tue Mar 10, 2009 9:01 am

1 Replies

1965 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
Mismatch in PROCAR and PARCHG

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by sjh_lapw » Tue Mar 10, 2009 5:36 am

1 Replies

2413 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
...electronic polarization with Berry-phase....

Last post by support_vasp « Wed Sep 11, 2024 2:23 pm
Replies: 1
by brocks » Fri Jul 20, 2007 9:03 am

1 Replies

3492 Views

Last post by support_vasp
Wed Sep 11, 2024 2:23 pm
It is possible using vasp to simulate the mechanical properties?

Last post by support_vasp « Wed Sep 11, 2024 2:22 pm
Replies: 1
by fanghz » Thu May 21, 2009 2:04 am

1 Replies

2531 Views

Last post by support_vasp
Wed Sep 11, 2024 2:22 pm
steps of bulk calculation to determine the optimized parameters

Last post by support_vasp « Wed Sep 11, 2024 2:22 pm
Replies: 1
by gump_813 » Sun Mar 08, 2009 8:35 am

1 Replies

2076 Views

Last post by support_vasp
Wed Sep 11, 2024 2:22 pm
Core Level Shifts / XPS -- experience with quaility of results?

Last post by support_vasp « Wed Sep 11, 2024 2:22 pm
Replies: 1
by janh » Mon Dec 01, 2008 6:36 pm

1 Replies

2655 Views

Last post by support_vasp
Wed Sep 11, 2024 2:22 pm
Macroscopic polarization calculation (LCALCPOL = .TRUE.)

Last post by support_vasp « Wed Sep 11, 2024 2:21 pm
Replies: 1
by ynwu » Wed Aug 04, 2010 6:34 pm

1 Replies

2790 Views

Last post by support_vasp
Wed Sep 11, 2024 2:21 pm
outcar file in NEB calculations

Last post by support_vasp « Wed Sep 11, 2024 2:21 pm
Replies: 1
by castella » Mon Aug 02, 2010 6:34 pm

1 Replies

2564 Views

Last post by support_vasp
Wed Sep 11, 2024 2:21 pm

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