CO2 reduction using aluminum hydride: Generation of in‐situ frustrated Lewis pairs and small molecule activation therein

H Mondal, PK Chattaraj - Journal of Computational Chemistry, 2024 - Wiley Online Library
CO2 reduction is appealing for the long‐term production of high‐value fuels and chemicals.
Herein, using density functional theory (DFT) based calculations, we study the CO2 …

Unraveling Reactivity Pathways: Dihydrogen Activation and Hydrogenation of Multiple Bonds by Pyramidalized Boron‐Based Frustrated Lewis Pairs

H Mondal, PK Chattaraj - ChemistryOpen, 2024 - Wiley Online Library
The activation of H2 by pyramidalized boron‐based frustrated Lewis Pairs (FLPs)(B/E‐FLP
systems where “E” refers to N, P, As, Sb, and Bi) have been explored using density …