Using VASP

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soft and augmentation electrons

Last post by support_vasp « Thu Sep 12, 2024 8:15 am
Replies: 1
by askhetan » Wed Oct 31, 2012 3:46 pm

1 Replies

2042 Views

Last post by support_vasp
Thu Sep 12, 2024 8:15 am
Fixing atoms coordinates on my surfaces...

Last post by support_vasp « Thu Sep 12, 2024 8:14 am
Replies: 1
by danith » Wed Oct 31, 2012 11:39 am

1 Replies

1327 Views

Last post by support_vasp
Thu Sep 12, 2024 8:14 am
LEXCH in POTCAR for hybrid functionals

Last post by support_vasp « Thu Sep 12, 2024 8:14 am
Replies: 1
by martonak » Thu Jul 19, 2012 1:00 pm

1 Replies

1652 Views

Last post by support_vasp
Thu Sep 12, 2024 8:14 am
The part of surface calculations in section 10-Examples of the manual

Last post by support_vasp « Thu Sep 12, 2024 8:14 am
Replies: 1
by baliuzeger » Tue Oct 30, 2012 5:19 pm

1 Replies

1244 Views

Last post by support_vasp
Thu Sep 12, 2024 8:14 am
Convergence of the individual components of the stress tensor

Last post by support_vasp « Thu Sep 12, 2024 8:14 am
Replies: 1
by mkosa » Tue Oct 30, 2012 8:57 am

1 Replies

1428 Views

Last post by support_vasp
Thu Sep 12, 2024 8:14 am
the relation between magmom and electron spin

Last post by support_vasp « Thu Sep 12, 2024 8:14 am
Replies: 1
by beston » Sun Oct 28, 2012 4:31 pm

1 Replies

1189 Views

Last post by support_vasp
Thu Sep 12, 2024 8:14 am
BoltzTraP with VASP output

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by alirezaa66 » Thu Oct 25, 2012 11:48 pm

1 Replies

2106 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
which variable/type saves detailed information on partial wave/projector?

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by bsmile » Tue Dec 13, 2011 1:06 am

1 Replies

1147 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
HSE06 ISMEAR=?

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by wyxsdu » Mon Jun 04, 2012 4:02 pm

1 Replies

1392 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
REAL_OPTLAY: internal error

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by nate84 » Wed Feb 15, 2012 12:16 am

1 Replies

2356 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
problem about berryphase term in calculation of ferroelectric polarization

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by JuntingZhang » Tue Dec 13, 2011 4:31 pm

1 Replies

1432 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
ELFCAR not correct

Last post by support_vasp « Thu Sep 12, 2024 8:13 am
Replies: 1
by rjz9 » Mon Jun 04, 2012 8:57 pm

1 Replies

1628 Views

Last post by support_vasp
Thu Sep 12, 2024 8:13 am
Does VASP5 take into account the intraband transition for optics?

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by KurtG » Tue Dec 13, 2011 7:27 pm

1 Replies

1513 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
NPAR and NSIM

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by vasp_user » Sun Apr 01, 2012 7:47 am

1 Replies

1541 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
DIPOL by default

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by hypnos » Thu Jun 07, 2012 7:58 pm

1 Replies

1489 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
Molecular dynamic of Si with NPT ensemble

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by s9811016 » Tue Jun 14, 2011 3:00 pm

1 Replies

2333 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
atomic stress output in MD

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by luke419 » Wed Aug 29, 2012 11:14 am

1 Replies

1297 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
spin-orbit interactions and spin-polarized

Last post by support_vasp « Thu Sep 12, 2024 8:12 am
Replies: 1
by rex881026 » Wed Jul 18, 2012 10:45 am

1 Replies

1330 Views

Last post by support_vasp
Thu Sep 12, 2024 8:12 am
positive energy with HSE calculation on metal slab

Last post by support_vasp « Thu Sep 12, 2024 8:11 am
Replies: 1
by jo_201 » Wed Dec 14, 2011 11:33 pm

1 Replies

1708 Views

Last post by support_vasp
Thu Sep 12, 2024 8:11 am
K-point mesh density around Fermi energy

Last post by support_vasp « Thu Sep 12, 2024 8:11 am
Replies: 1
by darshw » Tue Oct 25, 2011 9:51 am

1 Replies

1433 Views

Last post by support_vasp
Thu Sep 12, 2024 8:11 am

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