About the KPUSE parameter in Band decomposed chargedensity
Posted: Wed May 27, 2009 1:07 pm
Dear VASP users,
Because the VASP manual doesn't mention any default value for KPUSE, I wonder in band decomposed chargedensity calulation what will happen if the KPUSE parameter is not assigned any value at all? is there a default value for KPUSE? or Dose VASP calculate the charge density contributed by all the electrons in the specified range of energy and by all the states (k-point)?
Thank you very much,
O. P. Vu
<span class='smallblacktext'>[ Edited ]</span>
Because the VASP manual doesn't mention any default value for KPUSE, I wonder in band decomposed chargedensity calulation what will happen if the KPUSE parameter is not assigned any value at all? is there a default value for KPUSE? or Dose VASP calculate the charge density contributed by all the electrons in the specified range of energy and by all the states (k-point)?
Thank you very much,
O. P. Vu
<span class='smallblacktext'>[ Edited ]</span>