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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…
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Keywords:
electronic catalytic;
properties bimetallic;
structural electronic;
bimetallic clusters ... See more keywords
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Published in 2019 at "Chemistry of Materials"
DOI: 10.1021/acs.chemmater.9b02824
Abstract: Platinum is the most active anode and cathode catalyst in next-generation fuel cells using methanol as liquid source of hydrogen. Its catalytic activity can be significantly improved by alloying wi...
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Keywords:
clusters highly;
bimetallic clusters;
ptni bimetallic;
tuned skinned ... See more keywords
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Published in 2019 at "ACS Omega"
DOI: 10.1021/acsomega.9b01360
Abstract: Density functional theory was used to study dissociative chemisorption and desorption on PdxNiy (x + y = 6) bimetallic clusters. The H2 dissociative chemisorption energies and the H desorption energies at full H saturation were…
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Keywords:
dissociative chemisorption;
bimetallic clusters;
chemisorption desorption;
chemisorption ... See more keywords
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1
Published in 2022 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.2c05053
Abstract: The capability of precisely constructing bimetallic clusters with atomic accuracy provides exciting opportunities for establishing their structure-property correlations. However, the chemistry (the charge state of precursors, the property of ligands, the amount of dopant, and…
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Keywords:
aucd bimetallic;
chemistry;
bimetallic clusters;
reversible transformation ... See more keywords
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Published in 2019 at "Royal Society Open Science"
DOI: 10.1098/rsos.190342
Abstract: The stable structures of Ag–Au and Cu–Au clusters with 1 : 1, 1 : 3 and 3 : 1 compositions with up to 108 atoms are obtained using a modified adaptive immune optimization algorithm with…
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Keywords:
108 atoms;
study structures;
theoretical study;
structures bimetallic ... See more keywords
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Published in 2018 at "Russian Journal of Inorganic Chemistry"
DOI: 10.1134/s0036023618080168
Abstract: Nanocrystalline tin dioxide modified by Pd and Pt clusters or by bimetallic PdPt nanoparticles was synthesized. Distribution of the modifers on the SnO2 surface was studied by high-resolution transmission electron microscopy and energy dispersive X-ray…
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Keywords:
bimetallic clusters;
clusters sensing;
effect bimetallic;
nanocrystalline sno2 ... See more keywords
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1
Published in 2019 at "Physical Chemistry Research"
DOI: 10.22036/pcr.2019.182691.1621
Abstract: This article gives you proof that bimetallic transition metal clusters with the difference in electronegativity are better catalysts than monoatomic one. To prove this fact, a study of ethylene adsorption on bimetallic clusters vanadium-nickel VnNim…
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Keywords:
cluster;
vnnim;
study;
reactivity ... See more keywords
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Published in 2021 at "Revista de Chimie"
DOI: 10.37358/rc.21.3.8434
Abstract: Cognition to the metal-metal interactions is of vital importance for the catalytic process and would help exploring novel catalysts. In the present study, the model system of FexNiy (x + y = 6) bimetallic clusters…
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Keywords:
hydrogen;
dissociation;
bimetallic clusters;
study ... See more keywords