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Published in 2020 at "Advanced materials"
DOI: 10.1002/adma.202002401
Abstract: Newly discovered 2D Janus transition metal dichalcogenides layers have gained much attention from a theory perspective owing to their unique atomic structure and exotic materials properties, but little to no experimental data are available on…
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Keywords:
extreme pressures;
anomalous behavior;
behavior janus;
janus excitonic ... See more keywords
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Published in 2020 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.0c02199
Abstract: Using first-principles calculations, we demonstrate a combination of two emergent fields, type II van der Waals heterostructures and Janus structures, for the purpose of optimizing the harvesting o...
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Keywords:
nanoscale interfaces;
transition metal;
monolayers transition;
janus monolayers ... See more keywords
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Published in 2019 at "ACS nano"
DOI: 10.1021/acsnano.9b06698
Abstract: Inspired by the recent synthesis of monolayer MoSSe we conduct a first-principles high-throughput investigation of 216 MXY Janus monolayers consisting of a middle layer of metal atoms (M) sandwiched between different types of chalcogen, halogen,…
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Keywords:
optical properties;
electronic optical;
janus monolayers;
classifying electronic ... See more keywords
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Published in 2023 at "Materials horizons"
DOI: 10.1039/d2mh01362b
Abstract: A magnetic Janus monolayer, a special type of material which has asymmetric arrangements of its surface at the nanoscale, has been shown to present rather exotic properties for applications in spintronics and its intersections. This…
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Keywords:
van der;
der waals;
janus monolayers;
waals heterostructures ... See more keywords
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2
Published in 2023 at "Journal of Materials Chemistry A"
DOI: 10.1039/d3ta01177a
Abstract: Highly efficient and sustainable resources of energy are of great demand today to combat with environmental pollution and the energy crisis. In this work, we have examined the novel 2D...
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Keywords:
ternary janus;
thermoelectric photocatalytic;
efficient thermoelectric;
janus monolayers ... See more keywords
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Published in 2021 at "Physical Review B"
DOI: 10.1103/physrevb.104.104415
Abstract: The authors were supported by King Abdullah University of Science and Technology (KAUST) through the award OSR-2018-CRG7-3717 from the Office of Sponsored Research (OSR). This work used the resources of the Supercomputing Laboratory at King…
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Keywords:
transition metal;
monolayers magnetic;
magnetic transition;
janus monolayers ... See more keywords
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1
Published in 2022 at "International Journal of Molecular Sciences"
DOI: 10.3390/ijms23147629
Abstract: Janus Sb and Bi monolayers as a new class of 2D topological insulator materials, which could be fulfilled by asymmetrical functionalizations with methyl or hydroxyl, are demonstrated by first-principles spin–orbit coupling (SOC) electronic structure calculations…
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Keywords:
electronic valley;
valley;
rashba splitting;
splitting electronic ... See more keywords