Synthesis, structural and spectroscopic properties of orthorhombic compounds BaLnCuS3 (Ln = Pr, Sm)
Publication type: Journal Article
Publication date: 2020-08-01
scimago Q1
wos Q1
SJR: 1.192
CiteScore: 11.8
Impact factor: 6.3
ISSN: 09258388, 18734669
Materials Chemistry
Metals and Alloys
Mechanical Engineering
Mechanics of Materials
Abstract
Ternary sulfides BaPrCuS3 and BaSmCuS3 are first synthesized by the sulphidation reaction of a mixture of related oxides and metal Cu in a flow of (CS2, H2S) at 1170 K. The crystal structures of BaPrCuS3 and BaSmCuS3 are obtained by Rietveld method. BaPrCuS3 crystallizes in space group Pnma with unit cell parameters a = 10.56074(6), b = 4.11305(2) and c = 13.42845(7) A, V = 583.289 (5) A3, Z = 2 (structure type Eu2CuS3). BaSmCuS3 crystallizes in space group Cmcm with unit cell parameters a = 4.07269(4), b = 13.4499(1) and c = 10.3704(1) A, V = 568.06 (1) A3, Z = 2 (structure type KZrCuS3). The structural model is proposed for the Cmcm→Pnma transition in ABCX3 (X = S, Se) compounds for the sequence Sm-Pm-Nd-Pr. The dimensionless tolerance factor t = IR(A) × IR(C)/IR(B)2 is suggested to control the boundary between the Cmcm and Pnma structures. The micromorphological, thermal and spectroscopic properties are evaluated for BaPrCuS3. The compound melts incongruently at Tmelt = 1580.9 K. In BaPrCuS3, the band gap is estimated to be 2.1 eV. The vibrational parameters of BaPrCuS3 and BaSmCuS3 are comparatively observed by Raman spectroscopy.
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Azarapin N. O. et al. Synthesis, structural and spectroscopic properties of orthorhombic compounds BaLnCuS3 (Ln = Pr, Sm) // Journal of Alloys and Compounds. 2020. Vol. 832. p. 153134.
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Azarapin N. O., Aleksandrovsky A., Atuchin V. V., Krylov A. S., Molokeev M. S., Mukherjee S., Oreshonkov A. S., Gavrilova T., Andreev O. Synthesis, structural and spectroscopic properties of orthorhombic compounds BaLnCuS3 (Ln = Pr, Sm) // Journal of Alloys and Compounds. 2020. Vol. 832. p. 153134.
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TY - JOUR
DO - 10.1016/j.jallcom.2019.153134
UR - https://doi.org/10.1016/j.jallcom.2019.153134
TI - Synthesis, structural and spectroscopic properties of orthorhombic compounds BaLnCuS3 (Ln = Pr, Sm)
T2 - Journal of Alloys and Compounds
AU - Azarapin, Nikita O
AU - Aleksandrovsky, Aleksandr
AU - Atuchin, V. V.
AU - Krylov, Aleksandr S
AU - Molokeev, Maxim S.
AU - Mukherjee, Shaibal
AU - Oreshonkov, Aleksandr S.
AU - Gavrilova, Tatyana
AU - Andreev, Oleg
PY - 2020
DA - 2020/08/01
PB - Elsevier
SP - 153134
VL - 832
SN - 0925-8388
SN - 1873-4669
ER -
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@article{2020_Azarapin,
author = {Nikita O Azarapin and Aleksandr Aleksandrovsky and V. V. Atuchin and Aleksandr S Krylov and Maxim S. Molokeev and Shaibal Mukherjee and Aleksandr S. Oreshonkov and Tatyana Gavrilova and Oleg Andreev},
title = {Synthesis, structural and spectroscopic properties of orthorhombic compounds BaLnCuS3 (Ln = Pr, Sm)},
journal = {Journal of Alloys and Compounds},
year = {2020},
volume = {832},
publisher = {Elsevier},
month = {aug},
url = {https://doi.org/10.1016/j.jallcom.2019.153134},
pages = {153134},
doi = {10.1016/j.jallcom.2019.153134}
}