Aromaticity in metallacyclobutadienes from the perspective of the valence bond theory

Luis Rincón

doi:10.1002/qua.560500304

Aromaticity in metallacyclobutadienes from the perspective of the valence bond theory

Luis Rincón^*

^*Corresponding author for this work

Instituto Venezolano de Investigaciones Científicas (I.V.I.C.)

Research output: Contribution to journal › Article › peer-review

3 Scopus citations

Abstract

The valence bond method has been implemented for the study of π‐electron systems using a semiempirical CNDO‐type Hamiltonian. The algorithm used is based on the Clifford algebra realization of the Rumer–Weyl basis presented by Paldus et al. Using this version of the CNDO–VB approach, the effect of the metal hybridization in the electronic delocalization of metallacyclobutadienes is discussed. © 1994 John Wiley & Sons, Inc.

Original language	English
Pages (from-to)	189-196
Number of pages	8
Journal	International Journal of Quantum Chemistry
Volume	50
Issue number	3
DOIs	https://doi.org/10.1002/qua.560500304
State	Published - 15 Apr 1994
Externally published	Yes

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title = "Aromaticity in metallacyclobutadienes from the perspective of the valence bond theory",

abstract = "The valence bond method has been implemented for the study of π‐electron systems using a semiempirical CNDO‐type Hamiltonian. The algorithm used is based on the Clifford algebra realization of the Rumer–Weyl basis presented by Paldus et al. Using this version of the CNDO–VB approach, the effect of the metal hybridization in the electronic delocalization of metallacyclobutadienes is discussed. {\textcopyright} 1994 John Wiley \& Sons, Inc.",

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AB - The valence bond method has been implemented for the study of π‐electron systems using a semiempirical CNDO‐type Hamiltonian. The algorithm used is based on the Clifford algebra realization of the Rumer–Weyl basis presented by Paldus et al. Using this version of the CNDO–VB approach, the effect of the metal hybridization in the electronic delocalization of metallacyclobutadienes is discussed. © 1994 John Wiley & Sons, Inc.

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ER -

Aromaticity in metallacyclobutadienes from the perspective of the valence bond theory

Abstract

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