First-Principles Investigation of the Early 3d Transition Metal Diatomic Chlorides and Their Ions, ScCl0,±, TiCl0,±, VCl0,±, and CrCl0,±-Reference-Cited by-同舟云学术

First-Principles Investigation of the Early 3d Transition Metal Diatomic Chlorides and Their Ions, ScCl0,±, TiCl0,±, VCl0,±, and CrCl0,±

Published:2009-05-20 Issue:24 Volume:113 Page:6818-6840
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Kardahakis Stavros¹,Mavridis Aristides¹

Affiliation:

1. Laboratory of Physical Chemistry, Department of Chemistry, National and Kapodistrian University of Athens, P.O. Box 64 004, 15710 Zografou, Athens, Greece

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp901225y

Reference75 articles.

1. See for instance:Stanton, J. F.; Gauss, T.Advances in Chemical Physics;Prigogine, I., Rice, S. A., Eds.Wiley:New York, 2003; p101and references therein.

2. Electronic Structure of Diatomic Molecules Composed of a First-Row Transition Metal and Main-Group Element (H−F)

3. Ab initio investigation of the ground and low-lying states of the diatomic fluorides TiF, VF, CrF, and MnF

4. Ab initio Study of the Diatomic Fluorides FeF, CoF, NiF, and CuF

5. First principles study of the diatomic charged fluorides MF±, M=Sc, Ti, V, Cr, and Mn

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