| Re: Compare the chemical potential of two system ( No.1 )|
- Date: 2010/01/29 13:18
- Name: T.Ozaki
One can find how to find the chemical potential in OpenMX at
In this sense, the difference can have a physical meaning when
the same electronic temperature is used for both the calculations.
Also, the vacuum level is usually calculated from the Hartree potential
at the center of vaccum in the unit cell.