Cargando…

Bonding Situation of σ‐E−H Complexes in Transition Metal and Main Group Compounds

The ambiguous bonding situation of σ‐E−H (E=Si, B) complexes in transition metal compounds has been rationalized by means of Density Functional Theory calculations. To this end, the combination of the Energy Decomposition Analysis (EDA) method and its Natural Orbital for Chemical Valance (NOCV) exte...

Descripción completa

Detalles Bibliográficos
Autores principales: Ríos, Pablo, Conejero, Salvador, Fernández, Israel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9804526/
https://www.ncbi.nlm.nih.gov/pubmed/35900796
http://dx.doi.org/10.1002/chem.202201920