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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 45, 1982 - Issue 2
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Original Articles

Cartesian expressions for electric multipole moment operators

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Pages 259-272 | Received 29 Sep 1980, Accepted 18 Sep 1981, Published online: 23 Aug 2006
 

Abstract

General cartesian expressions for multipole moment operators have been derived. For linear molecules a relationship between tensor components is given for any multipole order. As an illustration these expressions have been applied to the calculation of the first ten moments of the first row hydrides. For high order moments our results indicate that the nuclear contributions are predominant.

Additional information

Notes on contributors

Bernard Silvi

Also at Centre de Mécanique Ondulatoire Appliquée. CNRS, 19 Rue du Maroc, F-75019 Paris.

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