Using VASP

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order of occupancies in density matrix

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by umklapp » Mon Feb 14, 2011 5:05 pm

1 Replies

3573 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
Surface Dipole moment

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by Oscar_rp » Fri Feb 11, 2011 10:45 am

1 Replies

3362 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
Transmittance, Reflectance coefficients and Refractive index

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by sankh » Sat Jan 29, 2011 12:46 am

1 Replies

3613 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
Band decomposed charge density with spin orbit coupling

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by hchen » Thu Jan 27, 2011 7:16 pm

1 Replies

3449 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
Born effective charge calculation with spin-orbit

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by leostorm10 » Wed Jan 19, 2011 3:59 am

1 Replies

3374 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
Plotting of band strucure

Last post by support_vasp « Wed Sep 11, 2024 2:35 pm
Replies: 1
by surabhi_so_mh » Tue Jan 18, 2011 5:26 am

1 Replies

2932 Views

Last post by support_vasp
Wed Sep 11, 2024 2:35 pm
PROCAR with spin-orbit

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by spakinfo » Sat Jan 15, 2011 2:45 pm

1 Replies

3523 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
Warning: RLIMIT_MEMLOCK is 32768 bytes

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by kambiz » Thu Feb 10, 2011 4:07 am

1 Replies

3771 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
Bandstructure/DOS

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by gsrikanth248 » Mon Feb 07, 2011 5:08 pm

1 Replies

2789 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
How to run a calculation with hybrid functionals using B3PW91?

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by swen » Fri Feb 04, 2011 3:06 pm

1 Replies

3096 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
convergence problem in scf

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by umklapp » Tue Feb 01, 2011 8:51 pm

1 Replies

3177 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
Spin-Orbit-Coupling matrix elements

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by popov74 » Mon Jan 31, 2011 5:25 pm

1 Replies

4926 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
about constr_cell_relax.F

Last post by support_vasp « Wed Sep 11, 2024 2:34 pm
Replies: 1
by ntuxi » Fri Jan 14, 2011 5:19 am

1 Replies

3878 Views

Last post by support_vasp
Wed Sep 11, 2024 2:34 pm
HSE + SOC calculations

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by magnon963 » Wed Jan 12, 2011 5:55 am

1 Replies

4168 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
Bloch state coefficient

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by spinkaust » Tue Jan 11, 2011 3:44 pm

1 Replies

2851 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
Bloch state coefficient

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by spinkaust » Tue Jan 11, 2011 3:43 pm

1 Replies

2765 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
optical calculation in VASP 5

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by tofu » Tue Jan 11, 2011 5:49 am

1 Replies

3519 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
How to calculate the relativistic magnetic moment?

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by sharma » Tue Jan 11, 2011 5:49 am

1 Replies

3220 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
Can I use VASP for Superlattice structures?

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by triratna » Fri Jan 07, 2011 7:16 am

1 Replies

2933 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm
problems with bandstructure calculations

Last post by support_vasp « Wed Sep 11, 2024 2:33 pm
Replies: 1
by Lilia Woods » Thu Jan 06, 2011 9:01 pm

1 Replies

3220 Views

Last post by support_vasp
Wed Sep 11, 2024 2:33 pm

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