Landmarks in the theory of mass spectra

Intramolecular vibrational redistribution (IVR); Maximum entropy method; Phase space sampling; Statistical theory; Transition state; Statistical theory of mass spectra; RRKM theory; Statistical adiabatic channel model; Potential energy surface crossing; Maximum entropy theory; Kinetic energy release distributions

Abstract :

[en] Statistical theories of mass spectra are based on two assumptions. The first one, which postulates efficient phase space sampling, is substantiated by various experimentation and is now theoretically much better understood. The efficiency of phase space sampling can be estimated and is found to be quite good. Much effort remains to be done concerning the second assumption. A new impetus should be given to the concept of transition state. A better understanding of the role played by the conservation of angular momentum, the exact significance of transition state switching, and the incorporation of quantum effects are set as goals for the future. © 2000 Elsevier Science B.V.

Disciplines :

Chemistry

Author, co-author :

Lorquet, Jean-Claude ; Université de Liège > Relations académiques et scientifiques (Sciences)

Language :

English

Title :

Landmarks in the theory of mass spectra

Publication date :

2000

Journal title :

International Journal of Mass Spectrometry

ISSN :

1387-3806

Publisher :

Elsevier, Netherlands

Volume :

200

Issue :

1-3

Pages :

43-56

Peer reviewed :

Peer Reviewed verified by ORBi

Available on ORBi :

since 08 October 2015

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