Local softness, scanning tunneling microscopy, and surface reactivity

Within the finite temperature extension of density functional theory, it is shown that local softness measures the ability of a chemical system to gain or donate charge as the external potential changes. This feature allows a formal connection between local softness and scanning tunneling microscopy...

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Veröffentlicht in:	Journal of physical chemistry (1952) 1993, Vol.97 (4), p.783-785
Hauptverfasser:	Galvan, Marcelo, Dal Pino, Arnaldo, Wang, Jing, Joannopoulos, John D
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemistry Exact sciences and technology General and physical chemistry General. Nomenclature, chemical documentation, computer chemistry Theory of reactions, general kinetics. Catalysis. Nomenclature, chemical documentation, computer chemistry
Online-Zugang:	Volltext
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