Porous silicon carbide (SiC): a chance for improving catalysts or just another active-phase carrier?

G Tuci, Y Liu, A Rossin, X Guo, C Pham… - Chemical …, 2021 - ACS Publications
There is an obvious gap between efforts dedicated to the control of chemicophysical and
morphological properties of catalyst active phases and the attention paid to the search of …

SiC nanostructures toward biomedical applications and its future challenges

JS Ponraj, SC Dhanabalan, G Attolini… - Critical Reviews in …, 2016 - Taylor & Francis
The present work reviews current research activities for possible applications of silicon
carbide (SiC) nanostructures. The main attention is devoted to emerging biomedical …

The adsorption of bromomethane onto the exterior surface of aluminum nitride, boron nitride, carbon, and silicon carbide nanotubes: a PBC-DFT, NBO, and QTAIM …

MD Mohammadi, M Hamzehloo - Computational and Theoretical …, 2018 - Elsevier
The adsorption of bromomethane (CH 3 Br) onto the outer surface of the pristine armchair (5,
5) single-walled aluminum nitride nanotube (AlNNT), boron nitride nanotube (BNNT) …

First-principles study of CO and NO adsorption on transition metals doped (8, 0) boron nitride nanotube

Y **e, YP Huo, JM Zhang - Applied surface science, 2012 - Elsevier
To explore the novel application of boron nitride nanotube (BNNT), we have investigated the
structural, magnetic and electronic properties of CO and NO molecules adsorption on …

The adsorption of chlorofluoromethane on pristine and Ge-doped silicon carbide nanotube: a PBC-DFT, NBO, and QTAIM study

MD Mohammadi, IH Salih, HY Abdullah - Molecular Simulation, 2020 - Taylor & Francis
The feasibility of detecting the chlorofluoromethane (CFM) onto the outer surface of pristine
silicon carbide nanotube (SiCNT), as well as its germanium doped structures (SiCGeNT) …

The adsorption of bromochlorodifluoromethane on pristine and Ge-doped silicon carbide nanotube: a PBC-DFT, NBO, and QTAIM study

M Doust Mohammadi, HY Abdullah - Structural Chemistry, 2021 - Springer
In the present investigation, the feasibility of detecting the bromochlorodifluoromethane
(BCF) gas molecule onto the outer surface of pristine single-wall silicon carbide nanotube …

Carbon nanotubes doped with Ni, Pd and Pt: A density functional theory study of adsorption and sensing NO

S Demir, MF Fellah - Surface Science, 2020 - Elsevier
In present work, the Density-Functional-Theory computations were applied for the platinum,
nickel and palladium doped (6, 0) single-walled carbon nanotubes (SWCNTs) to investigate …

[HTML][HTML] N2O reduction over a fullerene-like boron nitride nanocage: A DFT study

MD Esrafili - Physics Letters A, 2017 - Elsevier
We study, for the first time, the adsorption and catalytic decomposition of N 2 O molecule
over a fullerene-like boron nitride nanocage (B 12 N 12) using density functional theory …

Can silicon carbide nanotubes sense carbon dioxide?

J Zhao, Y Ding - Journal of Chemical Theory and Computation, 2009 - ACS Publications
Detection of carbon dioxide (CO2) is very important in environmental, biological, and
industrial processes. Recent experiment showed that carbon nanotubes can act as chemical …

Nitrogen-doped graphene as an excellent candidate for selective gas sensing

CC Ma, XH Shao, DP Cao - Science China Chemistry, 2014 - Springer
The toxic gases, such as CO and NO, are highly dangerous to human health and even
cause the death of person and animals in a tiny amount. Therefore, it is very necessary to …