Quantum-chemical calculation of spectroscopic parameters for rotational spectroscopy
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- 15 April 2010
- journal article
- review article
- Published by Taylor & Francis in International Reviews in Physical Chemistry
- Vol. 29 (2), 273-367
- https://doi.org/10.1080/01442351003643401
Abstract
This review provides a computational chemist's perspective of rotational spectroscopy and discusses the theoretical background and application of state-of-the-art quantum-chemical methods for the accurate determination of the relevant spectroscopic parameters.Keywords
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