[Pw_forum] Question of DOS at Ef
Paolo Giannozzi
giannozz at nest.sns.it
Fri Jun 3 13:57:55 CEST 2005
On Friday 03 June 2005 02:03, Lijun Zhang wrote:
> I wanted to calculate the accurate DOS at Fermi energy
> of some metal, how to do it?
the DOS at Fermi energy is not printed (except in the calculation
of electron-phonon coefficients) but the DOS at any energy can be
printed using postprocessing code "dos.x". The dos are calculated
in PP/dosg.f90 and flib/dost.f90, respectively for gaussian broadening
and tetrahedra
Paolo
--
Paolo Giannozzi e-mail: giannozz at nest.sns.it
Scuola Normale Superiore Phone: +39/050-509876, Fax:-563513
Piazza dei Cavalieri 7 I-56126 Pisa, Italy
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