Investigation of the CS structure of CO- 4 using ab initio calculations
Author:
Affiliation:
1. a Department of Chemistry , The University , Southampton , SO9 5NH , UK
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
https://www.tandfonline.com/doi/pdf/10.1080/00268979300101701
Reference14 articles.
1. Formation of the chelate bonds in the cluster O−2(CO2)n, CO−3(CO2)n, and NO−2(CO2)n
2. Anab initiomolecular orbital study of the anions O2-· H2O and O2-· CO2
3. Electron Attachment and Detachment. II. Mixtures of O2 and CO2 and of O2 and H2O
4. Ab initio study of the 1 A 1, ã 3 A″ and à 1 A″ states of formaldehyde
5. Effect of electron correlation on theoretical equilibrium geometries
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1. Infrared spectra of O2−∙(CO2)n clusters (n=1–6): Asymmetric docking at the π* orbital;The Journal of Chemical Physics;2005-08-15
2. Ab Initio Calculations on Al2N4 and AlNn (n = 4 to 7): Potential Precursors of High Energy Density Materials;The Journal of Physical Chemistry A;2002-08-15
3. Na2O and Na2O+: Thermodynamics and Low-Lying Electronic States;The Journal of Physical Chemistry A;2000-03-28
4. Ab initio investigation of the CO4 and CO2N2 molecules as possible high-energy metastable species;Journal of Molecular Structure: THEOCHEM;1996-09
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