In the current investigation, the hydrogen storage capability of Li-decorated B2N2
nanosheets is evaluated via periodic first-principles studies. The results of the present study …

Using an ab-initio study, we have examined the structural, electronic, vibrational and optical
properties of hexagonal boron-nitride (h-BN) based on density functional theory (DFT). The …

The pursuit of a material capable of storing a high capacity of hydrogen (H 2) efficiently has
prompted us to study the structural, electronic and H 2 storage properties of recently …

We predict a two-dimensional monolayer polymorph of boron nitride in an orthorhombic
structure (oB 2 N 2) using first-principles calculations. Structural optimization, phonon …

Hexagonal boron nitride (h-BN) is a semiconductor material with a wide band gap, which
has great potential to serve as a nanoresonators in microelectronics and mass and force …

Nanomaterials are classified as materials with an overall one exterior dimension within the
range of 1–100 nm. They are classified on the basis of the different dimensions such as zero …