Understanding the Physics and Chemistry of Reaction Mechanisms from Atomic Contributions: A Reaction Force Perspective

Studying chemical reactions involves the knowledge of the reaction mechanism. Despite activation barriers describing the kinetics or reaction energies reflecting thermodynamic aspects, identifying the underlying physics and chemistry along the reaction path contributes essentially to the overall und...

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Veröffentlicht in:	The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory Molecules, spectroscopy, kinetics, environment, & general theory, 2012-07, Vol.116 (27), p.7419-7423
Hauptverfasser:	Vöhringer-Martinez, Esteban, Toro-Labbé, Alejandro
Format:	Artikel
Sprache:	eng
Schlagworte:	Activation analysis Activation energy Atomic structure Barriers Chemical reactions Evolution Reaction kinetics Reaction mechanisms
Online-Zugang:	Volltext
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