Boron nitride nanotubes
This article presents an overview of the up-to-date developments in boron nitride nanotubes
(BNNTs), including theory, fabrication, structure, physical properties, chemical …
(BNNTs), including theory, fabrication, structure, physical properties, chemical …
Two-dimensional boron carbon nitride: a comprehensive review
Abstract Two-dimensional Boron Carbon Nitride (BCN) is a complex ternary system that has
recently attracted great attention due to its ability to be tuned over a range of chemical …
recently attracted great attention due to its ability to be tuned over a range of chemical …
Boron-nitride and boron-carbonitride nanotubes: synthesis, characterization and theory
We present in this review a joint experimental and theoretical overview of the synthesis
techniques and properties of boron-nitride (BN) and boron-carbonitride (BCN) nanotubes …
techniques and properties of boron-nitride (BN) and boron-carbonitride (BCN) nanotubes …
Understanding and calibrating density-functional-theory calculations describing the energy and spectroscopy of defect sites in hexagonal boron nitride
Defect states in 2-D materials present many possible uses but both experimental and
computational characterization of their spectroscopic properties is difficult. We provide and …
computational characterization of their spectroscopic properties is difficult. We provide and …
Defective structure of BN nanotubes: from single vacancies to dislocation lines
A combination of electron microscopy and theoretical calculations provides new insights into
the structure, electronics, and energetics of point defects and vacancy lines in BN single-wall …
the structure, electronics, and energetics of point defects and vacancy lines in BN single-wall …
Electronic structure and reactivity of boron nitride nanoribbons with stone-wales defects
Gradient-corrected density functional theory (DFT) computations were performed to
investigate the geometry, electronic property, formation energy, and reactivity of Stone …
investigate the geometry, electronic property, formation energy, and reactivity of Stone …
Adsorption of CO and NO molecules on carbon doped boron nitride nanotubes
Using first principles calculations, we have investigated the electronic and structural
properties of CO and NO molecules adsorbed on boron nitride nanotubes (BNNTs) and …
properties of CO and NO molecules adsorbed on boron nitride nanotubes (BNNTs) and …
Stone− wales defects in single-walled boron nitride nanotubes: formation energies, electronic structures, and reactivity
The geometries, formation energies, electronic properties, and reactivities of Stone− Wales
(SW) defects in single-walled (8, 0) boron nitride nanotubes (BNNTs) were investigated by …
(SW) defects in single-walled (8, 0) boron nitride nanotubes (BNNTs) were investigated by …
Hydrogen adsorption on carbon-doped boron nitride nanotube
The adsorption of atomic and molecular hydrogen on carbon-doped boron nitride nanotubes
is investigated within the ab initio density functional theory. The binding energy of adsorbed …
is investigated within the ab initio density functional theory. The binding energy of adsorbed …