Using VASP

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MD run of metalion-water cluster smass=2

Last post by support_vasp « Thu Sep 12, 2024 7:17 am
Replies: 1
by anilboda » Thu Jan 19, 2012 10:29 am

1 Replies

3196 Views

Last post by support_vasp
Thu Sep 12, 2024 7:17 am
Non-collinear magnetic calculations in the presence of an Electric Field

Last post by support_vasp « Thu Sep 12, 2024 7:17 am
Replies: 1
by saurabh_2802 » Sat Jun 15, 2013 9:54 pm

1 Replies

2959 Views

Last post by support_vasp
Thu Sep 12, 2024 7:17 am
spin polarized band decomposition charge density calculation

Last post by support_vasp « Thu Sep 12, 2024 7:17 am
Replies: 1
by lawlietVASP » Fri Nov 29, 2013 5:36 am

1 Replies

2880 Views

Last post by support_vasp
Thu Sep 12, 2024 7:17 am
how to perform a tensions test with VASP?

Last post by support_vasp « Thu Sep 12, 2024 7:17 am
Replies: 1
by dyc_2008 » Wed Mar 13, 2013 7:00 am

1 Replies

2297 Views

Last post by support_vasp
Thu Sep 12, 2024 7:17 am
Materials for collecting impinging heliostat fields

Last post by support_vasp « Thu Sep 12, 2024 7:17 am
Replies: 1
by Sonny » Mon Aug 12, 2013 2:53 pm

1 Replies

2447 Views

Last post by support_vasp
Thu Sep 12, 2024 7:17 am
MD with SMASS = -1

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by kambiz » Mon Mar 03, 2014 5:20 am

1 Replies

2670 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
Everything about corelevels

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by EL » Fri Jun 20, 2014 8:50 am

1 Replies

2589 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
warning from lattyp

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by ido » Fri Sep 20, 2013 11:49 am

1 Replies

2580 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
PDOS and KPOINTS

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by chimistelct » Thu Sep 22, 2011 3:56 pm

1 Replies

2407 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
Reduced Masses

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by mrmol » Wed Nov 16, 2011 4:29 pm

1 Replies

2503 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
Memory Question

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by crajesh » Fri Sep 28, 2012 12:05 pm

1 Replies

2095 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
very different band structure from HSE06 and GW

Last post by support_vasp « Thu Sep 12, 2024 7:16 am
Replies: 1
by caesarmu » Sat Nov 30, 2013 5:26 am

1 Replies

2542 Views

Last post by support_vasp
Thu Sep 12, 2024 7:16 am
pV calculation using pstress

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by netscape88 » Thu Sep 25, 2014 2:53 pm

1 Replies

2919 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
MD segmentation fault

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by giacomo giorgi » Fri Jan 20, 2012 4:39 am

1 Replies

2880 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
Can the electron distribution being 0.5 for spin up and 0.5 for spin down in OUTCAR?

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by handxiaoxi » Sat Aug 11, 2012 4:30 am

1 Replies

2317 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
Computing electronic free energy

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by dEnvar » Fri Sep 28, 2012 7:52 pm

1 Replies

2648 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
Failure to get the fcc Al structure starting from bct structure

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by leoant » Mon Jun 17, 2013 7:52 pm

1 Replies

2489 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
direct minimization of kohn sham energy functional versus diagonalizing the kohn sham equations

Last post by support_vasp « Thu Sep 12, 2024 7:15 am
Replies: 1
by vasp_user » Tue Oct 29, 2013 8:55 am

1 Replies

2556 Views

Last post by support_vasp
Thu Sep 12, 2024 7:15 am
Dielectric constant as a function of low frequency

Last post by support_vasp « Thu Sep 12, 2024 7:14 am
Replies: 1
by yifitry » Fri Jun 20, 2014 4:31 pm

1 Replies

2733 Views

Last post by support_vasp
Thu Sep 12, 2024 7:14 am
How to get the kinetic energy of electrons in OUTCAR?

Last post by support_vasp « Thu Sep 12, 2024 7:14 am
Replies: 1
by tonyngch » Sat Aug 16, 2014 12:08 pm

1 Replies

2866 Views

Last post by support_vasp
Thu Sep 12, 2024 7:14 am

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