Accuracy of semiexperimental equilibrium structures: Sulfine as an example

Erstveröffentlichung

2020

Authors

Demaison, Jean

Vogt, Natalja

Ksenafontov, Denis N.

Wissenschaftlicher Artikel

Published in

Journal of molecular structure ; 1206 (2020). - Art.-Nr. 127676. - ISSN 0022-2860. - eISSN 1872-8014

Link to publication

https://dx.doi.org/10.1016/j.molstruc.2019.127676

Faculties

Fakultät für Naturwissenschaften

Institutions

Institut für Theoretische Chemie

Subject headings

[Free subject headings]: Ab initio | Semiexperimental structure | Equilibrium structure | Cubic force field | Sulfine | ROTATIONAL-CONSTANTS | INFRARED-SPECTRUM | ATOMIC PROPERTIES | BASIS-SETS | MOLECULES | BOND | SPECTROSCOPY | INTEGRATION | CHEMISTRY | SURFACES
[DDC subject group]: DDC 540 / Chemistry & allied sciences

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