Boron nitride, BN, for hydrogen storage emerged in the beginning of the millennium and there swiftly followed more than 15 years of efforts combining experimental laboratory works and to a greater extent computational predictions. BN has been considered mainly for the storage of molecular hydrogen, H , by physisorption and/or chemisorption over a wide range of temperatures, that is, between -196 °C and 300 °C. Yet its potential has gone beyond the sorption of H as it has been also, although less extensively, involved in chemical H storage. The present review aims at giving a comprehensive overview of the main experimental results and findings as well as of the different avenues worth being explored. A key lesson of this survey is that boron nitride may turn out to be a promising material for hydrogen storage at room conditions provided all the predictions come true. The "ball" is now in the lab experimenters' court.
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http://dx.doi.org/10.1002/cplu.201800168 | DOI Listing |
Nanoscale Adv
December 2024
Department of Chemical Engineering, Sirjan University of Technology Sirjan Iran https://scholar.google.com/citations?user=N6z-rHsAAAAJ&hl=en.
The potential applicability of the C nanocage and its boron nitride-doped analogs (CBN and CBN) as pyrazinamide (PA) carriers was investigated using density functional theory. Geometry optimization and energy calculations were performed using the B3LYP functional and 6-31G(d) basis set. Besides, dispersion-corrected interaction energies were calculated at CAM (Coulomb attenuated method)-B3LYP/6-31G(d,p) and M06-2X/6-31G(d,p) levels of theory.
View Article and Find Full Text PDFPhys Chem Chem Phys
January 2025
Department of Physics, Institute for Sustainable Energy and Environment, Virginia Commonwealth University, Richmond, VA, 23284, USA.
We propose a new stable three-dimensional (3D) porous and metallic boron nitride anode material, named h-BN, with good ductility for sodium-ion batteries (SIBs). Based on first-principles calculations and a tight-binding model, we demonstrate that the metallicity originates from the synergistic contribution of the p-orbital of the sp-hybridized B and N atoms, while the ductility is due to the unique configurations of B-B and N-N dimers in the structure. More importantly, this boron nitride allotrope exhibits a high reversible capacity of 582.
View Article and Find Full Text PDFNano Lett
January 2025
Department of Physics and Astronomy, Seoul National University, 08826 Seoul, Korea.
Quantum emitters in solid-state materials are highly promising building blocks for quantum information processing and communication science. Recently, single-photon emission from van der Waals materials has been reported in transition metal dichalcogenides and hexagonal boron nitride, exhibiting the potential to realize photonic quantum technologies in two-dimensional materials. Here, we report the generation of room temperature single-photon emission from exfoliated and thermally annealed single crystals of van der Waals α-MoO.
View Article and Find Full Text PDFJ Colloid Interface Sci
December 2024
College of Emergency Management, Nanjing Tech University, Nanjing 211816, China.
Lithium-ion batteries (LIBs) have broad application prospects in many fields because of their high energy density. However, the poor heat resistance of polyolefin membranes and uneven lithium deposition result in battery failure and even infamous thermal runaway behavior. To improve the intrinsic safety of batteries, fire-retardant, thermally conductive, electrospinning strategies are employed to acquire a functional polyacrylonitrile (PAN) nanofiber separator (PAN@FBN/TPP) containing modified boron nitride (FBN) and triphenyl phosphate (TPP).
View Article and Find Full Text PDFPolymers (Basel)
January 2025
Department of Chemical Engineering, University of Engineering and Technology, Peshawar 25000, Pakistan.
This study examines the influence of nanofillers on the ultraviolet (UV) penetration depth of photopolymer resins used in stereolithography (SLA) 3D printing, and their impact on printability. Three nanofillers, multiwalled carbon nanotubes (MWCNT), graphene nanoplatelets (xGNP), and boron nitride nanoparticles (BNNP), were incorporated into a commercially available photopolymer resin to prepare nanocomposite formulations. The UV penetration depth (Dp) was assessed using the Windowpane method, revealing a significant reduction with the addition of nanofillers.
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