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Published in 2020 at "Applied Physics Letters"
DOI: 10.1063/1.5142167
Abstract: In the quest to predict photoluminescent efficiency in rare-earth substituted inorganic phosphors, research has shown that materials consisting of ordered, rigid crystal structures tend to possess the highest photoluminescent quantum yields. A compound's Debye temperature…
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Keywords:
temperature;
rare earth;
substitution;
inorganic phosphors ... See more keywords
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Published in 2018 at "Physics of the Solid State"
DOI: 10.1134/s1063783418050190
Abstract: A method of estimating the interatomic pair interaction potential parameters for a binary substitution alloy with consideration for the deviation of its lattice parameter from the Vegard law is proposed. This method is used as…
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Keywords:
binary substitution;
alloy;
temperature;
substitution alloy ... See more keywords
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Published in 2018 at "Crystals"
DOI: 10.3390/cryst8120451
Abstract: Mechanical properties, electronic properties, and Debye temperatures of NixBy (Ni3B, Ni2B, Ni4B3 and NiB) compounds were obtained by the first principles calculations based on the density functional theory (DFT). The results showed that the formation…
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Keywords:
properties electronic;
nixby compounds;
mechanical properties;
compounds obtained ... See more keywords
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Published in 2018 at "Materials"
DOI: 10.3390/ma11081471
Abstract: The structural stability, mechanical properties, and Debye temperature of alloying elements X (X = Sc, Ti, Co, Cu, Zn, Zr, Nb, and Mo) doped Al3Li were systematically investigated by first-principles methods. A negative enthalpy of…
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Keywords:
stability;
stability mechanical;
al3li;
structural stability ... See more keywords