The recent observation of high flexibility in buckled boron nitride nanotubes (BNNTs) contradicts the pre-existing belief about BN nanotube brittleness due to the partially ionic character of bonding between the B and N atoms. However, the underlying mechanisms and relationships within the nanotube remained unexplored. This study reports for the first time the buckling mechanism in multi-walled BNNTs upon severe mechanical deformation. Individual BNNTs were deformed inside a transmission electron microscope (TEM) equipped with an in situ atomic force microscopy holder. High-resolution TEM images revealed that bent BNNTs form multiple rippling upon buckling. The critical strain to form the first ripple was measured as 4.1% and the buckling process was reversible up to 26% strain. As opposed to carbon nanotubes, the BNNTs buckled into V-shaped ripples rather than smooth wavy shapes. The rippling wavelength was quantified in terms of the outer diameter and thickness of the nanotubes. The BNNTs showed a larger rippling wavelength compared to that of CNTs with the same number of walls. This difference was explained by the tendency of BN structures to reduce the number of thermodynamically unfavorable B-B and N-N bonds at the sharp corners in the rippling regions. The BNNTs' structure also exhibited a higher fracture strain compared to their counterpart.
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http://dx.doi.org/10.1088/0957-4484/22/11/115702 | DOI Listing |
J Mol Model
December 2024
Physics Education Department, Faculty of Education, Tishk International University, 44001, Erbil, Kurdistan Region, Iraq.
Context: This research investigates two critical areas, providing valuable insights into the properties and interactions of boron nitride nanotubes (BNNTs). Initially, a variety of BNNT structures (BNNT(m,n)_x, where m = 3, 5, 7; n = 0, 3, 5, 7; x = 3-9) with different lengths and diameters are explored to understand their electronic properties. The study then examines the interactions between these nanotubes and several gases (CO, CO, CSO, HO, NO, NO, NO, O, ONH, and SO) to identify the most stable molecular configurations using the bee colony algorithm for global optimization.
View Article and Find Full Text PDFNanotechnology
November 2024
Department of Mechanical Engineering, State University of New York at Binghamton, Binghamton, NY 13902, United States of America.
Sci Rep
November 2024
Rocket Force University of Engineering, Xi'an, 710025, Shaanxi, China.
The 'gas‒liquid‒solid' mechanism annealing method was used to create a superhydrophobic boron nitride nanotube (BNNT) stainless steel mesh in a tube furnace at 1250 °C in an NH environment. Fe powder was used as a catalyst, and B:BO = 4:1 was used as the raw material. The water droplets on the surface of the superhydrophobic material had a contact angle of approximately 150° and a slide angle of approximately 3°.
View Article and Find Full Text PDFJ Mol Graph Model
October 2023
Multidisplinary Research Unit of Pure and Applied Chemistry, Department of Chemistry, Faculty of Science, Mahasarakham University, Kantharawichai, Maha Sarakham, 44150, Thailand; Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Kantharawichai, Maha Sarakham, 44150, Thailand. Electronic address:
The main challenge has been focused on ibuprofen drug detection and adsorption of boron nitride nanotube (BNNT) doping with transition metal (TM = Fe, Ni, and Pt) atoms using the density functional theory calculation in gas and water phases. The geometrical structures, adsorption energies, solvation energies, and electronic properties were examined. The optimized geometries show that the ibuprofen molecule oriented itself at different bond distances and angles with respect to BNNT surface.
View Article and Find Full Text PDFSmall
October 2024
Department of Mechanical Engineering, The University of Tokyo, Tokyo, 113-8656, Japan.
The controlled synthesis of 1D van der Waals (1D vdW) heterostructures, specifically single-walled carbon nanotubes encapsulated within boron nitride nanotubes (SWCNT@BNNT), presents a challenge due to an incomplete understanding of the factors influencing BNNT growth. This study investigates the growth yield of SWCNT@BNNT heterostructures produced using zeolite-supported SWCNT templates on SiO-coated Transmission Electron Microscopy (TEM) grids, which enable in situ synthesis and thorough evaluation of each step without compromising the nanotube structure. The high-resolution TEM analysis reveals a significant improvement in BNNT coverage on individual nanotubes, increasing from 9% to 42%, through optimization of the ammonia borane precursor amount.
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