Using VASP

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Accurate force-constants by using density functional perturbation theory

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by forsdan » Tue Dec 22, 2009 4:45 pm

1 Replies

2354 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
about PDOS error

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by lfm2008 » Fri Nov 27, 2009 6:08 am

1 Replies

1185 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
Error atfter one step VASP calculation

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by bxcute » Wed Nov 25, 2009 6:53 am

1 Replies

1485 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
how do i calculate force constant matrix

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by ali » Tue Nov 24, 2009 2:17 pm

1 Replies

1048 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
Why doesn't LORBIT=2 give me phase factors?

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by wangfei » Tue Nov 17, 2009 10:10 pm

1 Replies

1123 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
about magnetization in spin-orbit calculations

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by stoney » Tue Nov 17, 2009 3:14 am

1 Replies

1132 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
phonon & DOS

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by cindy » Thu Nov 12, 2009 3:17 am

1 Replies

1109 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
Calculate the DOS with B3LYP ?

Last post by support_vasp « Wed Sep 11, 2024 2:11 pm
Replies: 1
by VASP001 » Wed Nov 11, 2009 4:36 pm

1 Replies

1229 Views

Last post by support_vasp
Wed Sep 11, 2024 2:11 pm
force in NEB calculation

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by xianfeng » Wed Nov 11, 2009 8:46 am

1 Replies

1300 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
kpoint grid commensurate with lattice

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by tholme » Tue Nov 10, 2009 11:35 pm

1 Replies

1620 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
question about MD

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by ouuing » Tue Nov 10, 2009 2:51 pm

1 Replies

1216 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
MP2 calculations

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by pepsi » Mon Nov 02, 2009 6:20 pm

1 Replies

1610 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
dipoles

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by willow » Mon Nov 02, 2009 4:15 pm

1 Replies

1036 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
Some questions about label 'LASPH'

Last post by support_vasp « Wed Sep 11, 2024 2:10 pm
Replies: 1
by VASP001 » Fri Oct 30, 2009 4:57 pm

1 Replies

1596 Views

Last post by support_vasp
Wed Sep 11, 2024 2:10 pm
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

1144 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

1235 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

1071 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

1456 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

1381 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

1146 Views

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

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