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Published in 2018 at "Journal of Materials Science"
DOI: 10.1007/s10853-018-1987-z
Abstract: The burgeoning paradigm of high-throughput computations and materials informatics brings new opportunities in terms of targeted materials design and discovery. The discovery process can be significantly accelerated and streamlined if one can learn effectively from…
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Keywords:
binary wurtzite;
machine learning;
wurtzite superlattices;
learning properties ... See more keywords
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Published in 2017 at "Chinese Journal of Physics"
DOI: 10.1016/j.cjph.2017.05.014
Abstract: Abstract In this paper, we have studied the structural, electronic, elastic, magnetic and optical properties of the intermetallic XAl3 (X=Sc, Dy, Ho, Er, Tm, Yb and Lu) compounds through density functional theory (DFT). These properties…
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Keywords:
magnetic optical;
structural electronic;
optical properties;
elastic magnetic ... See more keywords
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Published in 2020 at "Journal of Magnesium and Alloys"
DOI: 10.1016/j.jma.2020.05.011
Abstract: Abstract This work reported the effect of extrusion speeds on the microstructures and mechanical properties of Mg-Ca binary alloy. The results showed that yield strength of the as-extruded Mg-1.2 wt.% Ca alloys decrease from ∼ 360 MPa…
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Keywords:
binary alloy;
effect extrusion;
speed;
properties binary ... See more keywords
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Published in 2018 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2017.11.128
Abstract: Abstract Linear supra-molecular liquid crystals, 4-(octyloxy) benzoic acid (8OBA) and 4-(octyloxy)-3-fluoro benzoic acid (8OBAF), have been synthesized. The structure of these compounds was investigated by NMR and FTIR. The thermal and phase behavior of these…
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Keywords:
binary mixtures;
phase;
derived hydrogen;
liquid crystals ... See more keywords
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Published in 2019 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2019.04.064
Abstract: Abstract As an extension of our previous work, thermodynamic and acoustic properties of binary mixtures of benzyl alcohol with propyl amine, di-propyl amine, diiso-propyl amine and tri-propyl amine have been investigated by measuring density and…
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Keywords:
alcohol;
propyl amine;
binary liquid;
properties binary ... See more keywords
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Published in 2018 at "Journal of Supercritical Fluids"
DOI: 10.1016/j.supflu.2018.02.006
Abstract: Abstract Critical temperatures and pressures were measured for five binary mixtures (DMC + n–hexane, DMC + n–heptane, DMC + n–octane, DMC + n–nonane and DMC + n–decane) and two ternary mixtures (DMC + n–hexane + n–octane and DMC + n–heptane + n–decane) covering whole composition interval. The critical properties were obtained from observing…
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Keywords:
binary mixtures;
ternary mixtures;
critical properties;
determination critical ... See more keywords
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Published in 2021 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.0c10448
Abstract: Lithium–sulfur (Li–S) batteries are one of the most promising substitutes for the current Li-ion battery system as a next-generation storage system because of their high theoretical energy density ...
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Keywords:
implication mechanical;
binary compounds;
obtained first;
properties binary ... See more keywords
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Published in 2022 at "RSC Advances"
DOI: 10.1039/d2ra02114e
Abstract: New stable stoichiometries in the Co–As system are investigated up to 100 GPa by the CALYPSO structure prediction method. In particular, we found three novel stable compounds of Co2As-Pnma, CoAs2-Pnnm, and CoAs3-C2/m at high pressure.…
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Keywords:
binary compounds;
pressure;
properties binary;
high pressure ... See more keywords
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Published in 2019 at "Monthly Notices of the Royal Astronomical Society"
DOI: 10.1093/mnras/stz1151
Abstract: Elastic properties play an important role in neutron stars and white dwarfs. They are crucial for modeling stellar oscillations and different processes in magnetars and in degenerate stars which enter compact binary systems. Using electrostatic…
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Keywords:
white dwarfs;
stars white;
centered cubic;
properties binary ... See more keywords
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Published in 2020 at "Polymers"
DOI: 10.3390/polym12112553
Abstract: To improve the thermal conductivity of a composite material, the filler dispersion and the interfacial adhesion between the filler and the matrix are important factors. A number of methods for satisfying these criteria are presented…
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Keywords:
graphene oxide;
binary filler;
boron nitride;
filler ... See more keywords