Multireference Ab Initio Study of the Ground and Low-Lying Excited States of Cr(CO)2 and Cr(CO)3-Reference-Cited by-同舟云学术

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Multireference Ab Initio Study of the Ground and Low-Lying Excited States of Cr(CO)2 and Cr(CO)3

Published:2013-05-01 Issue:18 Volume:117 Page:3861-3868
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Kim Joonghan¹,Kim Jeongho²,Ihee Hyotcherl³⁴

Affiliation:

1. Department of Chemistry, The Catholic University of Korea, Bucheon, 420-743, Republic of Korea

2. Department of Chemistry, Inha University, Incheon, 402-751, Republic of Korea

3. Center for Nanomaterials and Chemical Reactions, Institute for Basic Science, Daejeon, 305-701, Republic of Korea

4. Department of Chemistry, KAIST, Daejeon, 305-701, Republic of Korea

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp401128k

Reference86 articles.

1. Highly Reduced Metal Carbonyl Anions: Synthesis, Characterization, and Chemical Properties

2. Building Bridges Between Inorganic and Organic Chemistry(Nobel Lecture)

3. Mechanistic features of catalytic carbon monoxide hydrogenation reactions

4. Olefin rearrangement resulting from the gas-phase krypton fluoride laser photolysis of chromium hexacarbonyl

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1. Spectroscopic Characterization of Highly Excited Neutral Chromium Tricarbonyl;The Journal of Physical Chemistry A;2024-04-18

2. Photochemistry of transition metal carbonyls;Chemical Society Reviews;2022

3. Group VI Metal Complexes of Carbon Monoxide and Isocyanides;Reference Module in Chemistry, Molecular Sciences and Chemical Engineering;2021

4. The Electronic Structure of [Mn(V)═O]: What is the Connection between Oxyl Radical Character, Physical Oxidation State, and Reactivity?;ACS Catalysis;2016-09-28

5. Cost-Effective Treatment of Scalar Relativistic Effects for Multireference Systems: A CASSCF Implementation Based on the Spin-free Dirac–Coulomb Hamiltonian;Journal of Chemical Theory and Computation;2016-08-05

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