[Pw_forum] Re: Extracting the kinetic energy from the one-electron contribution

[Passerone, Daniele]

|Grepping a bit I've found that the postprocessing and totally unrelated
|utility pw2casino *does* compute the kinetic energy: you can use it to
|postprocess you data and get the total kinetic energy.


Thank you so much Lorenzo!
By the way... sometimes my results can be so messy that this utility 
could be renamed "casino2casino"....  :-)

Daniele

*************************************************************************
Dr. Daniele Passerone
Theory and atomistic simulation of materials group

Empa
Swiss Federal Laboratories for Materials Science and Research
nanotech at surfaces laboratory

Ueberlandstrasse 129 
CH-8600 Dübendorf
Switzerland
Tel.: +41-(0)44-8234877
Fax : +41-(0)44-8234031

E-mail in case of false blacklisting: daniele.passerone at hispeed.ch