Using VASP

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Reading output from ACFDT-RPA total energy calculations

Last post by support_vasp « Thu Sep 12, 2024 7:52 am
Replies: 1
by nwan » Tue Nov 11, 2014 4:34 pm

1 Replies

1509 Views

Last post by support_vasp
Thu Sep 12, 2024 7:52 am
Graphene INCAR FILE...

Last post by support_vasp « Thu Sep 12, 2024 7:52 am
Replies: 1
by rezorva » Tue Jan 17, 2012 9:42 am

1 Replies

2457 Views

Last post by support_vasp
Thu Sep 12, 2024 7:52 am
temperature

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by rrpalanichamy » Wed Nov 09, 2016 1:43 pm

1 Replies

1654 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
Constrained MD using andersen thermostat at 300K

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by sutapa.dutta » Wed Feb 11, 2015 11:32 am

1 Replies

1470 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
scaling behavior of VASP on Blue Gene/Q machine

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by haa » Tue Feb 10, 2015 5:30 pm

1 Replies

1406 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
kinetic and potential energy of eigenstate?

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by nwan » Thu Dec 24, 2015 9:47 am

1 Replies

1500 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
Speeding up MD runs

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by suddhasattwa » Sat Dec 19, 2015 8:25 am

1 Replies

1689 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
questions on regular,soft, and hard potentials

Last post by support_vasp « Thu Sep 12, 2024 7:51 am
Replies: 1
by luke419 » Wed Dec 16, 2015 7:18 am

1 Replies

1579 Views

Last post by support_vasp
Thu Sep 12, 2024 7:51 am
Charged System Calculations: Changing NELECT

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by mishralu » Mon Nov 30, 2015 1:50 pm

1 Replies

1540 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
TOTEN in the EXX step (EXX+RPA calculation)

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by chenhuang » Wed Nov 25, 2015 7:38 pm

1 Replies

1833 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
Interpolation of k-mesh for GW-BSE calculations

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by huangj3 » Wed Oct 28, 2015 6:54 pm

1 Replies

1634 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
G0W0 calculations for 2D single-layer materials

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by huangj3 » Wed Oct 28, 2015 6:49 pm

1 Replies

1644 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
Optical Dielectric Tensor with HSE

Last post by support_vasp « Thu Sep 12, 2024 7:50 am
Replies: 1
by Eugene » Tue Oct 20, 2015 10:33 pm

1 Replies

1959 Views

Last post by support_vasp
Thu Sep 12, 2024 7:50 am
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

1238 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

1317 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

1483 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

1137 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

1200 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

1520 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

1887 Views

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

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