Abstract
European Journal of Mass Spectrometry
Volume 13 Issue 1, Pages 97–100 (2007)
doi: 10.1255/ejms.831
Theory and experiment in mass spectrometry: a perspective on the relationship between computational modelling and experiment in gas-phase ion chemistry
Einar Uggerud
Department of Chemistry, University of Oslo, PO Box
1033 Blindern, N-0315 Oslo, Norway. einar.uggerud@kjemi.uio.no
In this lecture/paper we will discuss the somewhat complicated relationship between theory and experiment in molecular science in general and mass spectrometry in particular, illustrated by some recent literature examples.
Keywords: computational chemistry, quantum chemistry, mass spectrometry, ion chemistry, kinetics, mechanism
Full-text article (211 kB) (Open Access Paper)
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