Journal of molecular graphics & modellingModelsMolecularBoron CompoundsDensity Functional TheoryElectrons
Structural preferences and multiple bonding interactions in hetero-closo-dodecaborates of group-14 elements - A theoretical study.
Brindha Veerappan, Krishnamoorthy Bellie Sundaram
Published: 202610.1016/j.jmgm.2025.109214
Abstract
The geometric and electronic structural features of group-14 hetero-closo-dodecaborates such as monomers [HEB11H11]-, [EB11H11]2- [E = C (1a), Si (2a), Ge (3a), Sn (4a) and Pb (5a)] and dimers [(EB11H11)2]2- [E = C (1), Si (2), Ge (3), Sn (4) and Pb…
Preview only. Read the full abstract at the source