vdW question
Posted: Tue Nov 15, 2011 4:39 pm
Hi,
I am implementing vdW correction in vasp5.2.11, using GGA-PBE. I only specify in my INCAR LVDW= .TRUE. and the parameters I let them by default.
In my OUTCAR, I have the T.E, and a Estimated vdW energy of -0.00098 eV. What surprise me is that the total energies in the OUTCAR and in the OSZICAR are identical, always, and should be changed a bit, isn't it? at least in the fourth decimal.
Could anybody tell me what I am doing wrong?
Thank you,
I am implementing vdW correction in vasp5.2.11, using GGA-PBE. I only specify in my INCAR LVDW= .TRUE. and the parameters I let them by default.
In my OUTCAR, I have the T.E, and a Estimated vdW energy of -0.00098 eV. What surprise me is that the total energies in the OUTCAR and in the OSZICAR are identical, always, and should be changed a bit, isn't it? at least in the fourth decimal.
Could anybody tell me what I am doing wrong?
Thank you,