Using VASP

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POTCAR for Pr and Gd in the LDA formalism

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by pratikdholabhai » Thu Oct 29, 2009 10:53 pm

1 Replies

1956 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
Still about GW calculation

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by giacomo giorgi » Thu Oct 29, 2009 7:56 am

1 Replies

2115 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
Cs bulk cohesive energy

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by chimaju » Sun Aug 16, 2009 4:48 am

1 Replies

1802 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
what does "Bulk calculations with internal parameters" stand for ?

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by VASP001 » Wed Oct 28, 2009 4:28 pm

1 Replies

2282 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
MD for VASP

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by deltz » Tue Oct 27, 2009 3:37 pm

1 Replies

2243 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
Ru vs Ru_pv pseudopotential

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by Matzep » Tue Oct 27, 2009 11:06 am

1 Replies

2043 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
Elastic constant under high pressure

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by tfb » Mon Oct 26, 2009 6:37 am

1 Replies

2420 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
Which Nose mass corresponds to SMASS=2?

Last post by support_vasp « Wed Sep 11, 2024 2:09 pm
Replies: 1
by helvetico » Thu Oct 22, 2009 2:47 pm

1 Replies

2186 Views

Last post by support_vasp
Wed Sep 11, 2024 2:09 pm
surface core level shifts

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by fatihgsen » Mon Aug 10, 2009 5:14 am

1 Replies

2453 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
k-point convergence for non-cillinear calculations

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by peterklaver » Wed Oct 21, 2009 9:28 am

1 Replies

2197 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
does vasp5.2 can calculate the phonon frequency ?

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by tfb » Thu Aug 06, 2009 12:34 pm

1 Replies

1962 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
strange energy ordering in G0W0 calculation

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by giacomo giorgi » Thu Sep 17, 2009 6:29 am

1 Replies

2030 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
Is it possible to calculate EELS in VASP?

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by nganbowm » Tue Sep 15, 2009 1:13 pm

1 Replies

3022 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
Potential in LOCPOT

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by BrianS » Mon Sep 14, 2009 3:07 pm

1 Replies

1997 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
question about simulated annealing

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by wenxuan » Fri Sep 04, 2009 6:11 am

1 Replies

2159 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
Density of State (DOS)

Last post by support_vasp « Wed Sep 11, 2024 2:08 pm
Replies: 1
by mahasinalam » Wed Sep 02, 2009 11:15 am

1 Replies

1930 Views

Last post by support_vasp
Wed Sep 11, 2024 2:08 pm
GW0 calculations

Last post by support_vasp « Wed Sep 11, 2024 2:07 pm
Replies: 1
by giacomo giorgi » Fri Aug 28, 2009 7:08 am

1 Replies

2035 Views

Last post by support_vasp
Wed Sep 11, 2024 2:07 pm
half electron due to 0.5_H pseudo atom

Last post by support_vasp « Wed Sep 11, 2024 2:07 pm
Replies: 1
by duncan2 » Tue Aug 25, 2009 4:01 am

1 Replies

2101 Views

Last post by support_vasp
Wed Sep 11, 2024 2:07 pm
How to calculate the excitonic optical properties in vasp5.2?

Last post by support_vasp « Wed Sep 11, 2024 2:07 pm
Replies: 1
by xfh00 » Tue Aug 25, 2009 3:06 am

1 Replies

1954 Views

Last post by support_vasp
Wed Sep 11, 2024 2:07 pm
Is the "Saw-Tooth" like potential implemented in VASP 5.2?

Last post by support_vasp « Wed Sep 11, 2024 2:07 pm
Replies: 1
by kevinyoh » Thu Jun 18, 2009 1:31 pm

1 Replies

2329 Views

Last post by support_vasp
Wed Sep 11, 2024 2:07 pm

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