Two-dimensional (2D) monolayer pristine MoS2 transition metal dichalcogenide (TMD) is
the most studied material because of its potential applications as nonprecious …

The oxygen reduction reaction (ORR) is an indispensable reaction in electrochemical
energy converting systems such as fuel cells. Generally, reaction kinetics of the ORR is slow …

Hydrogen (H2) is deemed as an attractive energy carrier alternative to fossil fuels, and it is
required to be stored for many applications. Physisorption is one of the promising ways to …

The triatomic system NeI2 is studied under the consideration that the diatom is found in an
excited electronic state (B). The vibrational levels (v= 13,…, 23) are considered within two …

Ultrathin two-dimensional Janus transition metal dichalcogenides (2D JTMDs) have
attracted much attention due to their potential applications in electrocatalysis, sensors, and …

A chapter on “Hydrogen: A Future Chemical Fuel” provides a basic knowledge of hydrogen
energy and its importance in modern society. Nowadays, the development of hydrogen …

Abstract Nowadays, 2D Transition Metal Dichalcogenides (in short TMDs) have gathered
intense recognition among researchers because of their potential features as an …

Metal‐organic frameworks (MOFs) are a new kind of solid porous materials built from metal
cations and organic bridging linkers or ligands. We considered a model MOF system using …

Theoretical studies of the potential energy surface and vibrational bound states calculations
were performed for the ground state of the Ne–Li2+ (X 2Σg+) van der Waals (vdW) complex …

Action spectra were recorded to identify the Ar⋯ I 2 intermolecular vibrational levels bound
within the Ar+ I 2 (B, ν′= 20–23) excited-state potentials. Features associated with …