Abstract Pyridine-M 2+[M= Mg, Ca] hosts have been identified as potent H 2 storage
material, and this has been explored by a variety of functionals within the density functional …

In current decade all countries are going to launch their National Hydrogen Energy Mission
with ambitious targets in the renewable energy sector and the push for hydrogen energy will …

Theoretical approaches for example quantum calculation and Monte Carlo (MC) simulations
are very much important in studying corrosion inhibitors due to a comparatively rapid …

The extrinsic catalytic properties of the laccase enzyme enable it to oxidize a wide range of
metallic compounds, making it an essential enzyme for producing biofuel. We have …

NHC-protected polynuclear Cu (I) clusters have found various applications in the field of
catalysis, bio-medicine and luminescence, and they exhibit remarkable advantages over …

This article illustrates the H 2 trapping potential of Li doped tri heteroatomic six-membered
aromatic Triazine isomers. The Li doped Triazine isomers are stabilized as a cation with …

This article depicts the synthesis of Ru (II)-NHC complex,[Ru (bpy)(NHC)(CH3CN) 2][PF6] 2
(2);[NHC= 1-methyl-2-(pyridyl) imidazo [1, 5-a] pyridine-2-yiledene] via Ag (I)-carbene trans …

New set of Ru-N-Heterocyclic Carbene (Ru-NHC) complexes 1a and 2a were synthesized
from their ligand precursors 1-Methyl-2-pyridin-2-yl-2H-imidazo [1, 5-a] pyridin-4-ylium …

In search of a potential hydrogen storage material, we have used three different aromatic N-
heterocyclic systems; Pyrazine, Pyrimidine, and Pyridazine. The alkali (Li, Na, and K) …

Aromatic triangular tri‐palladium cations 1–3, abbreviated as [Pd3]+, have shown interesting
photoelectric properties, Lewis basic character, and excellent activities in catalytic …