Using VASP

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band structure

Last post by support_vasp « Wed Sep 11, 2024 2:28 pm
Replies: 1
by apple » Tue Sep 28, 2010 3:11 am

1 Replies

2965 Views

Last post by support_vasp
Wed Sep 11, 2024 2:28 pm
ERROR from PRICEL

Last post by support_vasp « Wed Sep 11, 2024 2:28 pm
Replies: 1
by okuno » Wed Sep 22, 2010 8:36 am

1 Replies

3639 Views

Last post by support_vasp
Wed Sep 11, 2024 2:28 pm
For charged molecule relaxation, dipole correction is needed?

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by cenwanglai » Tue Sep 21, 2010 6:45 am

1 Replies

3373 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
Negative DOS and ISMEAR=-5

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by limkr » Mon Sep 20, 2010 7:33 pm

1 Replies

3513 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
Basic question

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by susantt » Mon Sep 13, 2010 12:07 am

1 Replies

2935 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
the dissociation energy

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by yidiandian1981 » Fri Sep 10, 2010 8:36 am

1 Replies

2787 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
Restart only from CONTCAR (NO WAVECAR)

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by giacomo giorgi » Fri Sep 10, 2010 8:24 am

1 Replies

3304 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
HSE optics calculation, heavy element having f electrons

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by tilak » Thu Sep 09, 2010 2:24 pm

1 Replies

2901 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
About POMASS in a Simulated annealing run

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by yjwang » Wed Sep 08, 2010 1:48 pm

1 Replies

3182 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
EFIELD

Last post by support_vasp « Wed Sep 11, 2024 2:27 pm
Replies: 1
by pramanikanup » Tue Sep 07, 2010 1:01 pm

1 Replies

3325 Views

Last post by support_vasp
Wed Sep 11, 2024 2:27 pm
Translation of the charge density

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by torehan » Fri Aug 27, 2010 10:02 pm

1 Replies

12918 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
how could I calculator the Hg without d electrons

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by zhaohuxian » Thu Aug 26, 2010 2:44 am

1 Replies

2747 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
What pseudopential should I use if i want to do meta-GGA calculation?

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by ynwu » Tue Aug 24, 2010 9:01 pm

1 Replies

2790 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
LSDA+U calculation

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by Santub » Mon Aug 23, 2010 4:32 pm

1 Replies

2860 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
How to get projector functions?

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by jhuatuci » Mon Aug 23, 2010 5:04 am

1 Replies

2676 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
TPSS functional

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by jlrch » Wed Aug 18, 2010 1:36 am

1 Replies

3255 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
EFIELD_PEAD tag in VASP 5.2.2

Last post by support_vasp « Wed Sep 11, 2024 2:26 pm
Replies: 1
by sigi14 » Tue Aug 17, 2010 11:53 pm

1 Replies

3612 Views

Last post by support_vasp
Wed Sep 11, 2024 2:26 pm
ISMEAR for a mixture system of graphene and Fe particles

Last post by support_vasp « Wed Sep 11, 2024 2:25 pm
Replies: 1
by limkr » Thu Aug 12, 2010 4:48 pm

1 Replies

3727 Views

Last post by support_vasp
Wed Sep 11, 2024 2:25 pm
Ions in VASP?

Last post by support_vasp « Wed Sep 11, 2024 2:25 pm
Replies: 1
by gwr » Wed Aug 11, 2010 11:30 pm

1 Replies

3118 Views

Last post by support_vasp
Wed Sep 11, 2024 2:25 pm
TD-HSE

Last post by support_vasp « Wed Sep 11, 2024 2:25 pm
Replies: 1
by nanofish » Fri Apr 30, 2010 4:08 pm

1 Replies

3013 Views

Last post by support_vasp
Wed Sep 11, 2024 2:25 pm

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