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Nanomaterials for Magnetism and Catalysis
Nanomaterials possess unique physical and chemical properties allowing for advancement and innovation in diverse scientific and technological fields. The remarkable magnetic and catalytic properties of these nanomaterials ...
Accelerated Search of Catalysts Using Density Functional Theory and Machine Learning
The need for clean and renewable energy resources has propelled the interest in designing new catalysts producing energy from renewable resources and alternate cleaner fuels such as hydrogen, methane, ammonia, ethylene, ...
Computational Modeling of two Dimensional Heterostructures for Optoelectronic and Catalytic Applications
Two-dimensional van der Waals (2D-vdW) materials have attracted significant attention for their unique and excellent properties. The properties of the 2D-vdW materials can be precisely engineered using various techniques ...
Cobalt-nhc Complexes and Diazabutadienes in Activation of Mono/Diboron Compounds and Their Application in C-b Coupling Reactions
Boronic acid(esters) have been well recognized as an indispensable coupling partner in the Suzuki-Miyaura cross coupling reactions producing a vast spectrum of molecules, applicable in the diverse field ranging from medicinal ...
Activation of H–E (E = H, Si, B, C) σ-Bond by Iridium and Rhodium Pincer Complexes: Implications in Catalytic (De)hydrogenation Reactions
Methane is a major constituent of natural gas and crude oil. Due to its abundance, methane is attractive from the standpoint of its utilization and conversion into value-added products.1 This process involves activation ...
Asymmetric Catalysis: From Atroposelective Organocatalysis to Iridium-Catalyzed Generation of Central Chirality
Thesis Abstract:
This thesis, entitled as “Asymmetric Catalysis: From Atroposelective Organocatalysis to
Iridium-Catalyzed Generation of Central Chirality” is divided into three chapters.
Chapter 1, highlights the ...