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σ-Hole and LP-Hole Interactions of Pnicogen···Pnicogen Homodimers under the External Electric Field Effect: A Quantum Mechanical Study

[Image: see text] σ-Hole and lone-pair (lp)-hole interactions within σ-hole···σ-hole, σ-hole···lp-hole, and lp-hole···lp-hole configurations were comparatively investigated on the pnicogen···pnicogen homodimers (PCl(3))(2), for the first time, under field-free conditions and the influence of the ext...

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Detalles Bibliográficos
Autores principales: Ibrahim, Mahmoud A. A., Moussa, Nayra A. M., Saad, Sherif M. A., Ahmed, Muhammad Naeem, Shawky, Ahmed M., Soliman, Mahmoud E. S., Mekhemer, Gamal A. H., Rady, Al-shimaa S. M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8992284/
https://www.ncbi.nlm.nih.gov/pubmed/35415328
http://dx.doi.org/10.1021/acsomega.2c00176