Orbital Localization-Driven Disruption of Peripheral Bonding in Valence-Isoelectronic B <sub>12</sub> <sup>–</sup> Clusters

, driven by analogous 1c-2e lone-pair formation on the substituted atom arising from the enhanced s-orbital stabilization and increased s-p splitting.

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Publication Details

Journal
The Journal of Physical Chemistry A
Published
2026-04-01
DOI
https://doi.org/10.1021/acs.jpca.6c00814
Primary Topic
Boron and Carbon Nanomaterials Research
Type
article
Field-Weighted Citation Impact
0.00

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article

Orbital Localization-Driven Disruption of Peripheral Bonding in Valence-Isoelectronic B 12 – Clusters

Iaroslav E. Gureev, Ivan A. Popov
The Journal of Physical Chemistry A
Boron and Carbon Nanomaterials Research
article

Orbital Localization-Driven Disruption of Peripheral Bonding in Valence-Isoelectronic B 12 – Clusters

Iaroslav E. Gureev, Ivan A. Popov
article en

Abstract

, driven by analogous 1c-2e lone-pair formation on the substituted atom arising from the enhanced s-orbital stabilization and increased s-p splitting.

The Journal of Physical Chemistry AVol. 130(14)
Washington State University (US)
Washington State University
Openalex Percentile: Top 31%
Boron and Carbon Nanomaterials Research
DOISourceOpenAlex
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