Theoretical investigation of the interaction of CH4 with Al-2 and Al-3 neutral and charged clusters

Erstveröffentlichung

2010

Authors

Alexandrou, Eleni, I

Gross, Axel

Bacalis, Naoum C.

Wissenschaftlicher Artikel

Published in

Journal of chemical physics ; 132 (2010), 15. - Art.-Nr. 154701. - ISSN 0021-9606. - eISSN 1089-7690

Link to publication

https://dx.doi.org/10.1063/1.3376174

Faculties

Fakultät für Naturwissenschaften

Institutions

Institut für Theoretische Chemie

Subject headings

[Free subject headings]: aluminium | atomic clusters | atom-molecule reactions | binding energy | bonds (chemical) | charge exchange | density functional theory | desorption | dissociation | ion-molecule reactions | metal clusters | organic compounds | reaction kinetics theory | vibrational states | MOLECULAR-ORBITAL METHODS | DENSITY-FUNCTIONAL THEORY | COLLISION-INDUCED DISSOCIATION | SET MODEL CHEMISTRY | GAUSSIAN-TYPE BASIS | ALUMINUM CLUSTERS | 3RD-ROW ATOMS | DIMETHYLALUMINUM HYDRIDE | EQUILIBRIUM GEOMETRIES | ELECTRONIC-STRUCTURE
[DDC subject group]: DDC 530 / Physics | DDC 540 / Chemistry & allied sciences

Metadata

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