Using VASP

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What's the problem?

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by xfh00 » Thu Mar 05, 2009 9:54 am

1 Replies

1167 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
ionic step not converge

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by vaspGG » Mon Mar 02, 2009 9:03 am

1 Replies

1669 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
Propability current

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by kh » Tue Feb 17, 2009 11:52 am

1 Replies

1314 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
Spin-orbit coupling

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by goja25 » Fri Jan 16, 2009 3:13 pm

1 Replies

1472 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
Unit cell geometry

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by bandri » Wed Jan 14, 2009 1:07 pm

1 Replies

1492 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
NEB, transition metal oxide, spin multiplicity

Last post by support_vasp « Wed Sep 11, 2024 1:57 pm
Replies: 1
by dfcox » Mon Jan 12, 2009 3:33 pm

1 Replies

2105 Views

Last post by support_vasp
Wed Sep 11, 2024 1:57 pm
Berry phase calculation

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by azurezhang » Mon Jan 12, 2009 9:54 pm

1 Replies

1345 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
pressure unity

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by rghomari » Fri Jan 09, 2009 10:46 pm

1 Replies

1244 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
A query of "dangling bonds" calculation by using VASP

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by pang_qing » Fri Jan 09, 2009 1:37 pm

1 Replies

1258 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
LDA+U hangs after POTLOK

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by marla » Sat Dec 27, 2008 8:28 pm

1 Replies

1564 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
is the occupation not reliable in non-selfconsistent calculation

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by njuxyh » Tue Aug 05, 2008 12:52 pm

1 Replies

1267 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
band structure calculation -- error reading file KPOINTS, line 4

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by socks » Mon Dec 01, 2008 9:59 am

1 Replies

2283 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
force convergence : difficult to acheive for Y2Ti2O7

Last post by support_vasp « Wed Sep 11, 2024 1:56 pm
Replies: 1
by prithwish » Sat Nov 29, 2008 12:32 pm

1 Replies

3656 Views

Last post by support_vasp
Wed Sep 11, 2024 1:56 pm
dipolar correction

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by FLC » Wed Nov 26, 2008 12:10 pm

1 Replies

1274 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
relative energy in charged system

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by TMAC » Mon Nov 24, 2008 2:43 am

1 Replies

1538 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
ERROR: there must be 1 or 3 items on line 2 of POSCAR

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by cosmos » Fri Sep 26, 2008 6:17 am

1 Replies

4105 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
about high pressure calculation

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by GUAN » Mon Nov 17, 2008 5:12 am

1 Replies

1732 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
reaction parameters

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by chemical02 » Fri Sep 19, 2008 4:52 pm

1 Replies

1352 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
some problems about NUPDOWN

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by linglin » Wed Nov 12, 2008 6:07 am

1 Replies

1415 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm
neb results analysis

Last post by support_vasp « Wed Sep 11, 2024 1:55 pm
Replies: 1
by lanjh » Wed Apr 09, 2008 7:52 am

1 Replies

1682 Views

Last post by support_vasp
Wed Sep 11, 2024 1:55 pm

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