Using VASP

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when does ISIF=3 decide to change cell parameters?

Last post by admin « Mon May 23, 2005 8:10 am
Replies: 1
by eijck » Thu May 19, 2005 4:32 pm

1 Replies

23574 Views

Last post by admin
Mon May 23, 2005 8:10 am
LDA+U

Last post by admin « Thu Apr 28, 2005 1:57 pm
Replies: 1
by windiks » Tue Feb 01, 2005 9:34 pm

1 Replies

25783 Views

Last post by admin
Thu Apr 28, 2005 1:57 pm
dielectric constant

Last post by admin « Thu Apr 28, 2005 1:54 pm

by admin » Thu Apr 28, 2005 1:54 pm

0 Replies

23086 Views

Last post by admin
Thu Apr 28, 2005 1:54 pm
GGA and VOSKOWN use

Last post by admin « Wed Apr 27, 2005 10:49 am
Replies: 1
by rc1ph » Tue Apr 26, 2005 6:32 pm

1 Replies

28413 Views

Last post by admin
Wed Apr 27, 2005 10:49 am
GGA+U and adsorption site preference

Last post by admin « Fri Apr 22, 2005 2:44 pm
Replies: 2
by dcurulla » Tue Mar 08, 2005 8:07 am

2 Replies

36648 Views

Last post by admin
Fri Apr 22, 2005 2:44 pm
how to handle the problem about "Sub-Space-Matrix is not hermitian in DAV "

Last post by admin « Fri Apr 22, 2005 2:29 pm

by admin » Fri Apr 22, 2005 2:29 pm

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28094 Views

Last post by admin
Fri Apr 22, 2005 2:29 pm
anti-ferromagnetic Fe

Last post by admin « Fri Apr 22, 2005 2:18 pm
Replies: 1
by peterklaver » Thu Apr 21, 2005 10:43 am

1 Replies

30949 Views

Last post by admin
Fri Apr 22, 2005 2:18 pm
PBE functional

Last post by admin « Mon Apr 11, 2005 1:37 pm
Replies: 1
by adelvitt » Wed Mar 16, 2005 12:04 pm

1 Replies

31029 Views

Last post by admin
Mon Apr 11, 2005 1:37 pm
deuterium pseudopotential

Last post by admin « Mon Apr 11, 2005 1:35 pm
Replies: 1
by davidloffreda » Fri Mar 18, 2005 10:21 am

1 Replies

31424 Views

Last post by admin
Mon Apr 11, 2005 1:35 pm
Spin polarised calculation

Last post by Veronika « Thu Mar 03, 2005 8:43 am
Replies: 1
by baki » Wed Mar 02, 2005 2:41 pm

1 Replies

30681 Views

Last post by Veronika
Thu Mar 03, 2005 8:43 am
About spin project in Spin-orbital coupling calculation

Last post by admin « Tue Feb 22, 2005 3:41 pm

by admin » Tue Feb 22, 2005 3:41 pm

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27794 Views

Last post by admin
Tue Feb 22, 2005 3:41 pm

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