Calculating Inverse Participation Ratio - Reading WAVECAR
Posted: Tue May 15, 2007 3:59 am
Dear Friends.
I want to calculate the Inverse Participation Ratio, and this information is in the WAVECAR file, generated by the vasp calculations. But, I don´t know how to read this file, because is a binary one.
Can anyone help me????
(To calculate the IPR I need the wavefunctions or the coefficients of them)
I want to calculate the Inverse Participation Ratio, and this information is in the WAVECAR file, generated by the vasp calculations. But, I don´t know how to read this file, because is a binary one.
Can anyone help me????
(To calculate the IPR I need the wavefunctions or the coefficients of them)