By the employment of molecular dynamic simulations (MD), we investigated the mechanical properties of defective single-walled Boron nitride nanotubes (SWBNNTs) with zigzag and …
Abstract 2D materials present promising features, but their intrinsic defects, especially at high temperatures, should be considered for usage under harsh conditions. Molecular …
Y Rostamiyan, V Mohammadi… - Journal of Molecular …, 2020 - Springer
Abstract Single-, double-, and triple-walled beryllium oxide nanotubes (BeONTs) along with BeO nanopeapods were simulated and geometrically optimized under the density functional …
HS Jahromi, AR Setoodeh - Materials Research, 2020 - SciELO Brasil
Silicon nanotubes (SiNTs) have been successfully synthesized recently. Despite the wide potential applications of SiNTs, their mechanical properties are rarely reported. In this study …
H Badjian, AR Setoodeh - Physica B: Condensed Matter, 2017 - Elsevier
Synthesizing inorganic nanostructures such as boron nitride nanotubes (BNNTs) have led to immense studies due to their many interesting functional features such as piezoelectricity …
AR Setoodeh, H Badjian, HS Jahromi - Journal of molecular modeling, 2017 - Springer
Graphene is known for its exceptional mechanical and electrical properties when in the form of a hexagonal monolayer of carbon atoms. In this study, the mechanical properties of …
M Cetin, M Kirca - Physical Chemistry Chemical Physics, 2023 - pubs.rsc.org
In recent years, antimonene nanotubes have attracted considerable interest for diverse applications owing to their promising physical properties. In this study, classical molecular …
AR Setoodeh, H Badjian - Materials Research Express, 2017 - iopscience.iop.org
The most stable form of boron nitride polymorph naming hexagonal boron nitride sheet has recently been widely concerned like graphite due to its interesting features such as electrical …
J Davoodi, M Soleymani, HA Sabet - Silicon, 2018 - Springer
The aim of this investigation was to study thermal properties of perfect and imperfect single- walled Si-x% Ge (atomic percentages) armchair nanotubes. We have performed molecular …