Structural, electronic and catalytic properties of bimetallic Pt Ag (n=1–7) clusters
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Alloys and Compounds"
DOI: 10.1016/j.jallcom.2020.155897
Abstract: Abstract The geometrical, electronic and catalytic properties of PtnAgn (n = 1–7) clusters are investigated by means of density functional theory (DFT) computations. The ground state structures are obtained by a structure search procedure based in the… read more here.
Keywords: electronic catalytic; properties bimetallic; structural electronic; bimetallic clusters ... See more keywords
Asymmetric surfaces endow Janus bismuth oxyhalides with enhanced electronic and catalytic properties for the hydrogen evolution reaction.
Sign Up to like & getrecommendations! Published in 2022 at "Journal of colloid and interface science"
DOI: 10.1016/j.jcis.2022.03.009
Abstract: The electronic and catalytic properties of Janus bismuth oxyhalide (Bi2O2XY, where X/Y = Cl, Br, or I, and X ≠ Y) for the hydrogen evolution reaction (HER) are evaluated through first-principles calculations. Janus Bi2O2XY shows an enhanced separation efficiency of… read more here.
Keywords: janus; janus bismuth; electronic catalytic; catalytic properties ... See more keywords
The structural, electronic and catalytic properties of Aun (n = 1–4) nanoclusters on monolayer MoS2
Sign Up to like & getrecommendations! Published in 2017 at "RSC Advances"
DOI: 10.1039/c7ra07591j
Abstract: The structural stability, electronic and catalytic properties of Aun (n = 1–4) nanoclusters supported on monolayer MoS2 have been investigated based on first principle DFT calculation with van der Waals (vdW) corrections. Our results show… read more here.
Keywords: electronic catalytic; catalytic properties; van der; properties aun ... See more keywords
Electronic and catalytic engineering in two-dimensional vdW metal–organic frameworks through alloying
Sign Up to like & getrecommendations! Published in 2021 at "Applied physics reviews"
DOI: 10.1063/5.0051219
Abstract: Bimetallic metal-organic framework (MOFs) alloys, in which heterogeneous metal clusters are incorporated into their backbone, are capable of highly selective separations and catalysis. Due to limitations in our fundamental understanding of their alloying, however, established… read more here.
Keywords: electronic catalytic; metal cation; metal organic; two dimensional ... See more keywords
Atomic layer deposition of transition metal films and nanostructures for electronic and catalytic applications
Sign Up to like & getrecommendations! Published in 2020 at "Critical Reviews in Solid State and Materials Sciences"
DOI: 10.1080/10408436.2020.1819200
Abstract: Abstract Atomic layer deposition (ALD) has emerged as the technique of choice in the microelectronics industry, owing to its self-limiting nature, that allows conformal film deposition in highly confined spaces. However, while the ALD of… read more here.
Keywords: electronic catalytic; transition; atomic layer; deposition ... See more keywords