Investigation of spin-flip reactions of Nb + CH3CN by relativistic density functional theory-Reference-Cited by-同舟云学术

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Investigation of spin-flip reactions of Nb + CH3CN by relativistic density functional theory

Published:2012 Issue:19 Volume:14 Page:6833
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Li Qiang,Qiu Yi-Xiang,Chen Xian-Yang,Schwarz W. H. Eugen,Wang Shu-Guang

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2012/CP/C2CP23225A

Reference76 articles.

1. Selective Activation of Alkanes by Gas-Phase Metal Ions

2. The chemistry of atomic transition-metal ions: insight into fundamental aspects of organometallic chemistry

3. Organometallic chemistry in the gas phase

4. Reactions of monosubstituted alkanes with bare metal ions.

5. Bare transition metal atoms in the gas phase: reactions of M, M+, and M2+ with hydrocarbons

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1. Explaining the singlet complexes detected for the reaction Zr(3F) + CH3CH3 through a non-spin flip scheme;Journal of Molecular Modeling;2017-12-15

2. Activation of acetonitrile by gas-phase uranium: bond structure analysis and spin–flip reaction mechanism;Theoretical Chemistry Accounts;2017-09

3. Rationalizing the Low-Spin Products Observed for the Reactions M+CH3 CN (M=V, Nb,Ta) Through a Non-Spin Flip Scheme.;ChemistrySelect;2017-04-13

4. Theoretical Study on the Reaction Mechanism of Ti with CH3CN in the Gas Phase;The Journal of Physical Chemistry A;2016-07-12

5. Methane C–H bond activation by niobium oxides: Theoretical analyses of the bonding and reactivity properties of Nbomn+ (m = 1, 2; n = 0, 1, 2);Journal of Organometallic Chemistry;2016-01

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