Using VASP

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Strain and KPOINTS

Last post by support_vasp « Thu Sep 12, 2024 6:56 am
Replies: 1
by markmick » Wed Mar 16, 2016 5:46 am

1 Replies

2294 Views

Last post by support_vasp
Thu Sep 12, 2024 6:56 am
How to get VDW_C6 and VDW_R0 for elements beyond Xe?

Last post by support_vasp « Thu Sep 12, 2024 6:56 am
Replies: 1
by hat343 » Sun Mar 13, 2016 11:06 am

1 Replies

2146 Views

Last post by support_vasp
Thu Sep 12, 2024 6:56 am
Dielectric constant with pbe+u

Last post by support_vasp « Thu Sep 12, 2024 6:56 am
Replies: 1
by SvenM » Thu Mar 23, 2017 11:56 am

1 Replies

2817 Views

Last post by support_vasp
Thu Sep 12, 2024 6:56 am
Question on PROCAR Precision

Last post by support_vasp « Thu Sep 12, 2024 6:55 am
Replies: 1
by paulfons » Sat Mar 18, 2017 3:13 am

1 Replies

2257 Views

Last post by support_vasp
Thu Sep 12, 2024 6:55 am
Maximum value of NGXF & Bader analysis

Last post by support_vasp « Thu Sep 12, 2024 6:55 am
Replies: 1
by 5-903 » Thu Mar 09, 2017 10:36 am

1 Replies

2795 Views

Last post by support_vasp
Thu Sep 12, 2024 6:55 am
I_CONSTRAINED_M=2

Last post by support_vasp « Thu Sep 12, 2024 6:55 am
Replies: 1
by sd » Tue Mar 07, 2017 7:00 am

1 Replies

2407 Views

Last post by support_vasp
Thu Sep 12, 2024 6:55 am
Advanced Tricks for Breaking Symmetry

Last post by support_vasp « Thu Sep 12, 2024 6:55 am
Replies: 1
by lizd » Tue Mar 07, 2017 6:59 am

1 Replies

2558 Views

Last post by support_vasp
Thu Sep 12, 2024 6:55 am
The energy is not converged for HSE06 with SOC calculation

Last post by support_vasp « Thu Sep 12, 2024 6:55 am
Replies: 1
by VASP001 » Fri Feb 24, 2017 3:13 am

1 Replies

2303 Views

Last post by support_vasp
Thu Sep 12, 2024 6:55 am
pair distribution function

Last post by support_vasp « Thu Sep 12, 2024 6:54 am
Replies: 1
by sandeep.kumar » Mon Feb 13, 2017 3:10 pm

1 Replies

2435 Views

Last post by support_vasp
Thu Sep 12, 2024 6:54 am
Vasp5.4.1 - BRMIX: old and new charge density differ

Last post by support_vasp « Thu Sep 12, 2024 6:54 am
Replies: 1
by pgarg8 » Fri Feb 03, 2017 6:27 pm

1 Replies

3615 Views

Last post by support_vasp
Thu Sep 12, 2024 6:54 am
Problem getting correct wavefunction

Last post by support_vasp « Thu Sep 12, 2024 6:54 am
Replies: 1
by zahra » Mon Jan 09, 2017 10:47 pm

1 Replies

2144 Views

Last post by support_vasp
Thu Sep 12, 2024 6:54 am
What terminates the cycle for hybrid HSE run?

Last post by support_vasp « Thu Sep 12, 2024 6:54 am
Replies: 1
by hess8 » Wed Nov 30, 2016 5:20 pm

1 Replies

2335 Views

Last post by support_vasp
Thu Sep 12, 2024 6:54 am
How to include spin orbit coupling for Pb in perovskite

Last post by support_vasp « Thu Sep 12, 2024 6:54 am
Replies: 1
by kalpna » Sat Nov 26, 2016 3:50 pm

1 Replies

2713 Views

Last post by support_vasp
Thu Sep 12, 2024 6:54 am
Calculating the effective mass

Last post by support_vasp « Thu Sep 12, 2024 6:53 am
Replies: 1
by hat343 » Tue Nov 22, 2016 7:29 am

1 Replies

2768 Views

Last post by support_vasp
Thu Sep 12, 2024 6:53 am
Calculation of polarization

Last post by support_vasp « Thu Sep 12, 2024 6:53 am
Replies: 1
by Iyyapparajan » Thu Nov 10, 2016 7:02 am

1 Replies

2751 Views

Last post by support_vasp
Thu Sep 12, 2024 6:53 am
AGGAC and BEEF-vdW

Last post by lucas.spiske « Wed Sep 11, 2024 6:42 pm
Replies: 2
by lucas.spiske » Tue Sep 10, 2024 10:55 am

2 Replies

1582 Views

Last post by lucas.spiske
Wed Sep 11, 2024 6:42 pm
The direction of the magnetization with vasp_ncl

Last post by support_vasp « Wed Sep 11, 2024 3:46 pm
Replies: 1
by tak10 » Mon Jan 15, 2018 8:07 am

1 Replies

2765 Views

Last post by support_vasp
Wed Sep 11, 2024 3:46 pm
Electronic Entropy from OUTCAR

Last post by support_vasp « Wed Sep 11, 2024 3:46 pm
Replies: 1
by rajeshraju » Tue Jan 09, 2018 1:20 pm

1 Replies

3120 Views

Last post by support_vasp
Wed Sep 11, 2024 3:46 pm
Combining finite electric field with spin orbit interaction

Last post by support_vasp « Wed Sep 11, 2024 3:46 pm
Replies: 1
by umklapp_sai » Sat Dec 02, 2017 5:30 pm

1 Replies

4186 Views

Last post by support_vasp
Wed Sep 11, 2024 3:46 pm
Atomization energy calculation in VASP.

Last post by support_vasp « Wed Sep 11, 2024 3:46 pm
Replies: 1
by Bikash_Patra » Thu Nov 16, 2017 2:29 pm

1 Replies

4204 Views

Last post by support_vasp
Wed Sep 11, 2024 3:46 pm

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