Using VASP

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PARCHG file generation

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by giacomo giorgi » Wed Oct 02, 2013 5:15 am

1 Replies

1801 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
how to have the kinetic, potential, exchange and correlation energy from VASP calculation

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by wen » Thu Oct 31, 2013 6:32 am

1 Replies

1689 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
total magnetization changes

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by M Dave » Wed Oct 30, 2013 3:03 pm

1 Replies

1677 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
monolayer

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by jyoti » Wed Jul 10, 2013 9:27 am

1 Replies

1871 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
parallel tempering in vasp

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by sammu09 » Tue Sep 24, 2013 1:43 am

1 Replies

1678 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
question on VASP manual -- simulated annealing

Last post by support_vasp « Thu Sep 12, 2024 9:01 am
Replies: 1
by ericsun » Wed Jul 10, 2013 5:32 am

1 Replies

1956 Views

Last post by support_vasp
Thu Sep 12, 2024 9:01 am
Find DOS using Spherical Jellium model for Au

Last post by support_vasp « Thu Sep 12, 2024 9:00 am
Replies: 1
by indatt » Sun Aug 18, 2013 9:53 am

1 Replies

1726 Views

Last post by support_vasp
Thu Sep 12, 2024 9:00 am
No convergence for dipole-corrected structural relaxation

Last post by support_vasp « Thu Sep 12, 2024 8:59 am
Replies: 1
by Lian » Wed May 15, 2013 1:28 pm

1 Replies

1761 Views

Last post by support_vasp
Thu Sep 12, 2024 8:59 am
thermal conductivity

Last post by support_vasp « Thu Sep 12, 2024 8:59 am
Replies: 1
by ccccc » Mon Jul 08, 2013 12:06 pm

1 Replies

1820 Views

Last post by support_vasp
Thu Sep 12, 2024 8:59 am
4f states in GW PAW datasets

Last post by support_vasp « Thu Sep 12, 2024 8:59 am
Replies: 1
by Torbjorn » Fri Jul 05, 2013 11:43 am

1 Replies

1605 Views

Last post by support_vasp
Thu Sep 12, 2024 8:59 am
Representing doping of graphene, band structures

Last post by support_vasp « Thu Sep 12, 2024 8:59 am
Replies: 1
by warchibald » Fri Jul 05, 2013 12:18 am

1 Replies

1969 Views

Last post by support_vasp
Thu Sep 12, 2024 8:59 am
Cu[Ga,In]Se2,S2 Crystal surface

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by cappri » Thu May 16, 2013 6:35 pm

1 Replies

1609 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
HSE06 exchange screening parameter

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by srinubarc » Wed May 15, 2013 6:30 am

1 Replies

1571 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
Nonmagnetic fully relativistic calculation

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by saishi » Tue May 14, 2013 10:11 am

1 Replies

1635 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
energy band calculation (error in results)

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by ccccc » Mon May 13, 2013 1:42 pm

1 Replies

1586 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
Strange LOCPOT Potential Values in InAs system.

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by Eugene » Fri May 25, 2012 3:11 am

1 Replies

2035 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
spin-orbit + metagga

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by Elena Arias » Tue Dec 18, 2012 8:44 pm

1 Replies

1533 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
Charged Species

Last post by support_vasp « Thu Sep 12, 2024 8:58 am
Replies: 1
by Ramesh » Tue Apr 02, 2013 1:58 pm

1 Replies

1633 Views

Last post by support_vasp
Thu Sep 12, 2024 8:58 am
optical absorption between VBM and impurity band

Last post by support_vasp « Thu Sep 12, 2024 8:57 am
Replies: 1
by handxiaoxi » Mon Apr 01, 2013 4:17 am

1 Replies

1795 Views

Last post by support_vasp
Thu Sep 12, 2024 8:57 am
did RWIGS changes afected the chargcar file

Last post by support_vasp « Thu Sep 12, 2024 8:57 am
Replies: 1
by pevil » Wed Jul 11, 2012 3:20 pm

1 Replies

1617 Views

Last post by support_vasp
Thu Sep 12, 2024 8:57 am

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