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полныйинформационныйкраткий
Поисковый запрос: (<.>K=Polychalcogenides<.>)
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    Evolution of structural, thermal, optical, and vibrational properties of Sc2S3, ScCuS2, and BaScCuS3 semiconductors / N. O. Azarapin, A. S. Oreshonkov, I. A. Razumkova [et al.] // Eur. J. Inorg. Chem. - 2021. - Vol. 2021, Is. 33. - P. 3355-3366, DOI 10.1002/ejic.202100292. - Cited References: 50. - The work was partially carried out using the resources of the Research Resource Center "Natural Resources Management and Physico-Chemical Research" (Tyumen University) with financial support from the Ministry of Science and Higher Education of the Russian Federation (contract No. 05.594.21.0019, UIN RFMEFI59420X0019). The Raman spectroscopic studies were carried out at the collaborative research center for vibrational spectroscopy at ISSC UB RAS (Ekaterinburg, Russia). I.I.L. would like to acknowledge the support from the Research Program No. AAAA-A19-119031890025-9 (ISSC UB RAS). The use of the equipment of Krasnoyarsk Regional Center of Research Equipment of the Federal Research Center "Krasnoyarsk Science Center SB RAS" is acknowledged." The authors are grateful to Dr. Elena V. Vladimirova (ISSC UB RAS) for technical assistance . - ISSN 1434-1948. - ISSN 1099-0682
РУБ Chemistry, Inorganic & Nuclear
Рубрики:
RARE-EARTH
   QUATERNARY CHALCOGENIDES

   CRYSTAL-STRUCTURES

Кл.слова (ненормированные):
Complex sulfides -- Density functional calculations -- DTA -- Polychalcogenides -- Rare earths
Аннотация: In the present work, we report on the synthesis of Sc2S3, ScCuS2 and BaScCuS3 powders using a method based on oxides sulfidation and modification of their properties. The crystal structures and morphology of samples are verified by XRD and SEM techniques. Thermal stability has been studied by DTA which has revealed that Sc2S3 decomposes to ScS through melting at 1877 K. ScCuS2 and BaScCuS3 melt incongruently at temperatures of 1618 K and 1535 K, respectively. The electronic structure calculations show that the investigated compounds are semiconductors with indirect band gap (Eg). According to the diffuse reflection spectroscopy, Sc2S3, ScCuS2 and BaScCuS3 are wide-bandgap semiconductors featured the Eg values of 2.53 eV, 2.05 eV and 2.06 eV, respectively. The band gap decreases with the introduction of copper (I) and barium cations into the crystal structure of the compounds. Variation of local structure has been verified by Raman and infrared spectroscopy. The calculated vibrational modes of ScCuS2 correspond to CuS4 and Sc−S layer vibrations, even though ScS6 octahedra-like structural units can be found in the structure.

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Держатели документа:
Tyumen State Univ, Dept Inorgan & Phys Chem, Tyumen 625003, Russia.
RAS, Fed Res Ctr KSC SB, Kirensky Inst Phys, Lab Mol Spect, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, Sch Engn & Construct, Krasnoyarsk 660041, Russia.
RAS, Fed Res Ctr KSC SB, Kirensky Inst Phys, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, Inst Nanotechnol Spect & Quantum Chem, Krasnoyarsk 660041, Russia.
RAS, Fed Res Ctr KSC SB, Inst Chem & Chem Technol, Krasnoyarsk 660041, Russia.
Russian Acad Sci, Ural Branch, Inst Solid State Chem, Ekaterinburg 620990, Russia.

Доп.точки доступа:
Azarapin, N. O.; Oreshonkov, A. S.; Орешонков, Александр Сергеевич; Razumkova, I. A.; Aleksandrovsky, A. S.; Александровский, Александр Сергеевич; Maximov, N. G.; Leonidov, I. I.; Shestakov, N. P.; Шестаков, Николай Петрович; Andreev, O. V.; Ministry of Science and Higher Education of the Russian Federation [05.594.21.0019, UIN RFME-FI59420X0019]; ISSC UB RAS [AAAA-A19-119031890025-9]
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