Ab initio Study of the Diatomic Fluorides FeF, CoF, NiF, and CuF-Reference-Cited by-同舟云学术

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

Published:2008-10-09 Issue:44 Volume:112 Page:11235-11250
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Koukounas Constantine¹,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/jp805034w

Reference98 articles.

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

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

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

4. Large atomic natural orbital basis sets for the first transition row atoms

5. Systematically convergent basis sets for transition metals. I. All-electron correlation consistent basis sets for the 3d elements Sc–Zn

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