Various issues with EFIELD_PEAD
Posted: Sun Aug 07, 2011 1:44 pm
Using vasp 5.2.2 and vasp 5.2.12 I have run the NaF example as described in http://cms.mpi.univie.ac.at/vasp/vasp/E ... ields.html.
I get values of the dipole moment and the dielectric constant that are very close to the ones given there, but my value of the "E" column is around 32 times smaller than the one given there. Has anyone tried to run this example and got the same answers as in the manual?
I obtain forces that are zero to the sixth decimal place. Should they not be different from zero in the presence of the field?
Thanks,
Oswaldo Dieguez
I get values of the dipole moment and the dielectric constant that are very close to the ones given there, but my value of the "E" column is around 32 times smaller than the one given there. Has anyone tried to run this example and got the same answers as in the manual?
I obtain forces that are zero to the sixth decimal place. Should they not be different from zero in the presence of the field?
Thanks,
Oswaldo Dieguez