Using VASP

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NEB calculation and parallelization

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by gVallverdu » Wed Jun 04, 2014 4:02 pm

1 Replies

996 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
How to "epsilon_diag_mic" part in vasprun.xml

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by nwan » Tue Nov 11, 2014 4:42 pm

1 Replies

1080 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
segmentation fault

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by captaincook » Wed Nov 07, 2012 2:43 pm

1 Replies

1184 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
layer

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by jyoti » Wed Jul 31, 2013 7:26 am

1 Replies

885 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
effective forces on the unit-cell vectors

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by reimers » Sun Jul 27, 2014 10:59 am

1 Replies

931 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
DOS and HSE06

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by mariafio » Tue Jul 24, 2012 12:46 pm

1 Replies

1255 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
RDF problem from MD output

Last post by support_vasp « Thu Sep 12, 2024 7:49 am
Replies: 1
by s9811016 » Thu Sep 13, 2012 10:03 am

1 Replies

1540 Views

Last post by support_vasp
Thu Sep 12, 2024 7:49 am
Incorrect dipole moment

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by amul1umt » Tue Jan 15, 2013 5:25 pm

1 Replies

1073 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
vdW parameters for Cerium

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by siddarth1753 » Fri Mar 01, 2013 9:09 pm

1 Replies

943 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
Applying finite electric field

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by miaoms » Wed Jun 13, 2012 8:26 pm

1 Replies

1581 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
tddft jobs in vasp

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by shyam » Sat Aug 31, 2013 11:52 am

1 Replies

1173 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
Determining Wavefunction Parity at a q-point using PROCAR projections

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by paulfons » Thu Jun 05, 2014 2:40 am

1 Replies

1317 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
electronic convergence

Last post by support_vasp « Thu Sep 12, 2024 7:48 am
Replies: 1
by tonyparsons » Tue Apr 23, 2013 5:59 pm

1 Replies

886 Views

Last post by support_vasp
Thu Sep 12, 2024 7:48 am
Small negative frequency after relaxation

Last post by support_vasp « Thu Sep 12, 2024 7:47 am
Replies: 1
by mikkkee » Wed Nov 20, 2013 2:44 pm

1 Replies

1023 Views

Last post by support_vasp
Thu Sep 12, 2024 7:47 am
Is relaxation with different AEXX allowed in VASP?

Last post by support_vasp « Thu Sep 12, 2024 7:47 am
Replies: 1
by Vahid Askarpour » Tue Nov 08, 2011 2:18 am

1 Replies

1204 Views

Last post by support_vasp
Thu Sep 12, 2024 7:47 am
Error with HSE06

Last post by support_vasp « Thu Sep 12, 2024 7:47 am
Replies: 1
by lexa » Wed Jul 25, 2012 10:03 am

1 Replies

759 Views

Last post by support_vasp
Thu Sep 12, 2024 7:47 am
Whether the DIPOL tag should be set, when I want to apply an external electronic field.

Last post by support_vasp « Thu Sep 12, 2024 7:47 am
Replies: 1
by xinhuanwen » Fri Sep 14, 2012 7:49 am

1 Replies

958 Views

Last post by support_vasp
Thu Sep 12, 2024 7:47 am
Problems with DFT-D2

Last post by support_vasp « Thu Sep 12, 2024 7:47 am
Replies: 1
by siddarth1753 » Tue Jun 04, 2013 6:31 am

1 Replies

824 Views

Last post by support_vasp
Thu Sep 12, 2024 7:47 am
Cell shape relaxation: k-points and symmetry

Last post by support_vasp « Thu Sep 12, 2024 7:46 am
Replies: 1
by sponza » Wed Nov 20, 2013 5:49 pm

1 Replies

963 Views

Last post by support_vasp
Thu Sep 12, 2024 7:46 am
EFIELD

Last post by support_vasp « Thu Sep 12, 2024 7:46 am
Replies: 1
by mahasinalam » Tue Feb 11, 2014 8:46 am

1 Replies

1146 Views

Last post by support_vasp
Thu Sep 12, 2024 7:46 am

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