Quantum-Chemical and Quantum-Graph Models of the Dynamical Structure of CH<sub>5</sub><sup>+</sup>-Reference-Cited by-同舟云学术

Quantum-Chemical and Quantum-Graph Models of the Dynamical Structure of CH₅⁺

Published:2022-12-19 Issue:1 Volume:19 Page:42-50
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Simkó Irén¹²³,Fábri Csaba³^ORCID,Császár Attila G.²³^ORCID

Affiliation:

1. Hevesy György PhD School of Chemistry, ELTE Eötvös Loránd University, Pázmány Péter sétány 1/A, H-1117 Budapest, Hungary

2. Laboratory of Molecular Structure and Dynamics, Institute of Chemistry, ELTE Eötvös Loránd University, Pázmány Péter sétány 1/A, H-1117 Budapest, Hungary

3. MTA-ELTE Complex Chemical Systems Research Group, P.O. Box 32, H-1518 Budapest 112, Hungary

Funder

Nemzeti Kutat?si Fejleszt?si ?s Innov?ci?s Hivatal

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c00991

Reference46 articles.

1. Quasistructural molecules

2. Structural quantum effects and three-centre two-electron bonding in CH+5

3. Topological Bifurcation Analysis: Electronic Structure of CH5+

4. Does CH5+ Have (a) “Structure?” A Tough Test for Experiment and Theory

5. Taming CH 5 + , the “enfant terrible” of chemical structures

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