Theoretical Study of the Insertion Reactions of Aluminum with H2O, NH3, HCl, and Cl2-Reference-Cited by-同舟云学术

Theoretical Study of the Insertion Reactions of Aluminum with H2O, NH3, HCl, and Cl2

Published:1998-01-16 Issue:6 Volume:102 Page:1005-1017
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Fängström Torbjörn¹,Lunell Sten¹,Kasai Paul H.¹,Eriksson Leif A.¹

Affiliation:

1. Department of Quantum Chemistry, Uppsala University, Box 518, S-751 20 Uppsala, Sweden, IBM Research Division, Almaden Research Center, 650 Harry Road, San Jose, California, and Department of Physics, Stockholm University, Box 6730, S-113 85 Stockholm, Sweden

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp972859h

Reference45 articles.

1. Characterization of aluminum atom insertion mechanisms into fluorine-hydrogen, oxygen-hydrogen, nitrogen-hydrogen, chlorine-hydrogen, sulfur-hydrogen and phosphorus-hydrogen bonds by ab initio MO methods

2. Ab initio study of the chemical reactivity of the aluminum atom with ether

3. Calculation of the electronic structures and spectra of several organic and inorganic radicals containing aluminum

4. Characterization of the intermediates formed in the reaction of Al atoms with H2O, H2S and H2Se by EPR spectroscopy

5. Laser vaporization generation of HA1OH, DA1OD and HAl17 OH for neon and argon matrix isolation electron spin resonance investigations. Comparison with theoretical calculations

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