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Dokumenttyp:
Zeitschriftenaufsatz 
Autor(en):
Pecchia, A., Gagliardi, A.; Solomon, G.C.; Di Carlo, A.; Frauenheim, T.; Reimers J.R. 
Titel:
Heat dissipation and nonequilibrium phonon distributions in molecular devices 
Abstract:
Using a density functional approach we compute vibrations of molecules adsorbed on metal and semiconducting substrates and the electronphonon coupling of these modes. A non-equilibrium Green’s function approach is used to compute the partially coherent transmission in molecular junctions due to electron-vibration scattering [1], [2]. The electronic power dissipated into molecular vibrations allows to set a rate equation for the phonon population in the vibrational degrees of fr...    »
 
Kongresstitel:
11th International Workshop on Computational Electronics TU Wien 
Kongress / Zusatzinformationen:
Vienna, Austria, May 25 - 27, 2006 
Zeitschriftentitel:
Journal of Computational Electronics, 6 (1), 335-339 
Jahr:
2007 
Jahr / Monat:
2006-05 
Quartal:
2. Quartal 
Monat:
May 
Heft / Issue:
335 - 339 
Print-ISSN:
ISBN 3-901578-16-1 
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