Results 21 to 30 of about 5,175 (259)
Strong Electron–Phonon Coupling Induced Self‐Trapped Excitons in Double Halide Perovskites
Double halide perovskites exhibit impressive potential for the self‐trapped exciton (STEs) luminescence. However, the detailed mechanism of the physical nature during the formation process of STEs in double perovskites is still ambiguous.
Baian Chen, Rui Chen, Bolong Huang
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Machine learning bandgaps of double perovskites [PDF]
AbstractThe ability to make rapid and accurate predictions on bandgaps of double perovskites is of much practical interest for a range of applications. While quantum mechanical computations for high-fidelity bandgaps are enormously computation-time intensive and thus impractical in high throughput studies, informatics-based statistical learning ...
G. Pilania +5 more
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Two-Dimensional Halide Pb-Perovskite–Double Perovskite Epitaxial Heterostructures
Epitaxial heterostructures of two-dimensional (2D) halide perovskites offer a new platform for studying intriguing structural, optical, and electronic properties. However, difficulties with the stability of Pb- and Sn-based heterostructures have repeatedly slowed the progress.
Singh, Ajeet +10 more
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Mathematical modeling of the perovskite and double perovskite crystal structures
The paper considers the problem of modeling materials with the crystal structure of perovskite and double perovskite. Due to the high complexity of obtaining micro- and nanoscale objects, data on the structure and properties of such materials are especially important.
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Halide perovskites recently attracted wide attention for light emitting applications. Here, octahedral distortion in halide double perovskites Cs2AgMCl6, induced by the mixture of trivalent M-cations Bi3+, In3+, and Sb3+, gives rise to enhanced white ...
Tamilselvan Appadurai +5 more
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Multiferroic Compounds with Double-Perovskite Structures [PDF]
New multiferroic compounds with double-perovskite structures were synthesized. Bi2NiMnO6 was synthesized in bulk form by high-pressure synthesis and also in a thin-film form by epitaxial growth. The material showed both ferromagnetic and ferroelectric properties, i.e., the multiferroic property at low temperature.
Shimakawa, Yuichi +2 more
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The Duffy's model is reformulated for Sb3+ and Bi3+ in cubic chloro- and bromo-elpasolites with « 0D » perovskite structure. The new equation allows calculating the energy of the first s2 → s1p1 electron transition from crystal structure data. The Stokes
Philippe Boutinaud
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Chemical tuning of a double double perovskite oxide [PDF]
Chemical tuning has been demonstrated for the first time in a double double perovskite. Ordering over five cation sites is preserved in LaxCa1−xMnMnReO6 ferrimagnets up to x ≥ 0.5 while La3+/Ca2+ substitution tunes magnetic properties.
Azizah Almadhi +4 more
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Magnetic model for the ordered double perovskites [PDF]
12 pages latex, 10 ...
Sanyal, Prabuddha, Majumdar, Pinaki
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Machine learning for perovskite materials design and discovery
The development of materials is one of the driving forces to accelerate modern scientific progress and technological innovation. Machine learning (ML) technology is rapidly developed in many fields and opening blueprints for the discovery and rational ...
Qiuling Tao +3 more
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