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We investigate the stability of boron nitride conical sheets of nanometer size, using first-principles calculations. Our results indicate that cones with an antiphase boundary (a line defect that contains either B-B or N-N bonds) can be…

Materials Science · Physics 2009-11-10 Sergio Azevedo , Mario S. C. Mazzoni , Ricardo W. Nunes , H. Chacham

Heterogeneous catalysts consisting of supported metallic nanoparticles typically derive exceptional catalytic activity from their large proportion of under-coordinated surface sites which promote adsorption of reactant molecules.…

Materials Science · Physics 2022-10-03 James P. Horwath , Colin Lehman-Chong , Aleksandra Vojvodic , Eric A. Stach

Hexagonal boron nitride is a promising material for many applications ranging from deep UV emission to an ideal substrate for other two dimensional crystals. Although efforts towards the growth of wafer-scale, high quality material strongly…

We report on a two-step ultrahigh vacuum chemical vapor deposition synthesis of a vertical Ir(111)/borophene/hexagonal boron nitride heterostructure, using borazine as a single-source precursor. The process takes advantage of the finite…

Borophene, a monoatomic layer of boron atoms, stands out among two-dimensional (2D) materials, with its versatile properties of polymorphism, metallicity, plasmonics, superconductivity, tantalizing for physics exploration and…

Materials Science · Physics 2021-11-25 Qiyuan Ruan , Luqing Wang , Ksenia V. Bets , Boris I. Yakobson

We report on the growth of nanostructured rods fabricated by electrostatic co-assembly between iron oxide nanoparticles and polymers. The nanoparticles put under scrutiny, {\gamma}-Fe2O3 or maghemite, have diameter of 6.7 nm and 8.3 nm and…

Materials Science · Physics 2010-10-15 M. Yan , J. Fresnais , J. -F. Berret

We investigate by means of DFT/GGA+U calculations the electronic and structural properties of magnetic nanotubes composed of an iron oxide monolayer and (n,0) Boron Nitride (BN) nanotubes, with n ranging from 6 up to 14. The formation…

Mesoscale and Nanoscale Physics · Physics 2015-05-30 Ronaldo J. C. Batista , Alan B. de Oliveira , Natália R. Pereira , Rafael S. Paolini , Taíse M. Manhabosco

In order to understand the first stages of the nucleation of carbon nanotubes in catalytic processes, we present a tight-binding Monte Carlo study of the stability and cohesive mechanisms of different carbon structures deposited on nickel…

Materials Science · Physics 2009-11-13 Hakim Amara , Christophe Bichara , François Ducastelle

We propose a previously unexplored way to form Nb nanowires from NbCl$_3$ molecules inside carbon nanotubes (CNTs). We have studied this reaction by ab initio density functional calculations and found it to be catalytically promoted in…

Mesoscale and Nanoscale Physics · Physics 2019-12-09 Dan Liu , David Tomanek

Hexagonal boron nitride (h-BN) is well-established as a requisite support, encapsulant and barrier for 2D material technologies, but also recently as an active material for applications ranging from hyperbolic metasurfaces to room…

Symmetric minima of surface potential energy of a nanocatalyst act as nucleation sites for chirally selective initial growth of single walled carbon tubes at low temperatures. The nucleation sites are sites of maximum coordination number of…

Materials Science · Physics 2013-05-01 Anteneh G Tefera , Mogus D Mochena

Chemical vapor deposition synthesis of single-walled carbon nanotubes experiments, using Fe catalyst, and alternating methane and carbon monoxide as carbon feedstocks, lead to the reversible formation of junctions between tubes of different…

Understanding the kinetic selectivity of carbon nanotube growth at the scale of individual nanotubes is essential for the development of high chiral selectivity growth methods. Here we demonstrate that homodyne polarization microscopy can…

The selective etching of carbon nanotubes has been widely explored as a post-synthetic route for enriching semiconducting species. As nanoelectronic applications increasingly demand pure semiconducting nanotubes for use in field-effect…

Materials Science · Physics 2025-06-26 K. Otsuka , S. Maruyama

Boron nitride (BN) is today considered as one of the most promising materials for many novel applications including bright single photon emission, deep UV opto-electronics, small sized solid-state neutron detector, and high-performance…

Amorphous boron nitride (\textrm{$\alpha$}-BN) is a promising ultrathin barrier for nanoelectronics, yet the atomistic mechanisms governing its chemical stability remain poorly understood. Here, we investigate the structure-property…

We prepared three ferrite nanocatalysts: (i) copper ferrite (CuFe2O4), (ii) ferrite where cobalt was substituted by nickel (NixCo1-xFe2O4, with x= 0, 0.2, 0.4, 0.6), and (iii) ferrite where nickel was substituted by zinc (ZnyNi1-yFe2O4 with…

Materials Science · Physics 2011-09-01 R. Hosseini Akbarnejad , V. Daadmehr , F. Shahbaz Tehrani , F. Aghakhani , S. Gholipour

Industrial scale NH3 production is mainly produced by the Haber Bosch process, but it suffers from intensive energy consumption with serious CO2 emission. Electrochemical N2 reduction reaction (NRR) is now used for energy-saving NH3…

Materials Science · Physics 2019-09-02 Tongwei Wu , Yanning zhang

Boron nitride (BN) is a structurally versatile insulator since it can be found in several crystalline structures with interesting mechanical and electrical properties, making this material attractive for technological applications. Seeking…

The growth of nanotube films on various substrates and surfaces is vital for applications in nanoscale functional devices. We report a simple and versatile boron (B) ink painting method that enables high-density boron nitride nanotube…

Materials Science · Physics 2015-03-05 Lu Hua Li , Ying Chen , Alexey M. Glushenkov