Spectral state densities of sizable metal clusters are evaluated directly by resorting to an efficient algorithm (FOM), set up and formerly utilized in other computational contexts. Investigation of SCC, FCC and BCC cluster geometries, described according to a tight-binding model able to take into account size- and surface-effects, leads to convincing evidence of the excellent prerogatives of the approach. © 2004 Published by Elsevier B.V.

Direct evaluation of the density of states of simple metal clusters via forced oscillator method (FOM): A preliminary report / R. Conte, G.P. Arrighini, C. Guidotti. - In: CHEMICAL PHYSICS LETTERS. - ISSN 0009-2614. - 395:4-6(2004 Sep 11), pp. 290-295. [10.1016/j.cplett.2004.07.087]

Direct evaluation of the density of states of simple metal clusters via forced oscillator method (FOM): A preliminary report

R. Conte
Primo
;
2004

Abstract

Spectral state densities of sizable metal clusters are evaluated directly by resorting to an efficient algorithm (FOM), set up and formerly utilized in other computational contexts. Investigation of SCC, FCC and BCC cluster geometries, described according to a tight-binding model able to take into account size- and surface-effects, leads to convincing evidence of the excellent prerogatives of the approach. © 2004 Published by Elsevier B.V.
Settore CHIM/02 - Chimica Fisica
11-set-2004
Article (author)
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/2434/797658
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