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Solid-state Synthesis,Crystal and Band Structures,and Optical Properties of a Novel Ternary Sulfide Eu_2Ga_2S_5

Solid-state Synthesis,Crystal and Band Structures,and Optical Properties of a Novel Ternary Sulfide Eu_2Ga_2S_5
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摘要 One new ternary europium gallium sulfide, Eu2Ga2S5, has been synthesized by a facile solid-state route with boron as the reducing reagent. It crystallizes in the orthorhombic space group Pbca, with a = 11.976(1), b = 11.074(1), c = 17.446(1)A^°, V = 1650.6(3)A^°^3, and Z = 8. Its 3-D structure is built by the connection between EuS 7 monocapped trigonal prisms and GaS 4 tetrahedra, and the latter connect with each other to form layer-like slabs. Its optical energy gap is determined to be 2.17 eV, which is also verified by the electronic band structure calculation. One new ternary europium gallium sulfide, Eu2Ga2S5, has been synthesized by a facile solid-state route with boron as the reducing reagent. It crystallizes in the orthorhombic space group Pbca, with a = 11.976(1), b = 11.074(1), c = 17.446(1)A^°, V = 1650.6(3)A^°^3, and Z = 8. Its 3-D structure is built by the connection between EuS 7 monocapped trigonal prisms and GaS 4 tetrahedra, and the latter connect with each other to form layer-like slabs. Its optical energy gap is determined to be 2.17 eV, which is also verified by the electronic band structure calculation.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2017年第12期2115-2122,共8页 结构化学(英文)
基金 supported by Yangzhou Engineering Technology Research Center of Petrochemical New Materials(YZM2015086) Yangzhou Science and Technology Bureau(YZ2016269)
关键词 rare-earth sulfide solid-state reaction crystal structure band gap rare-earth sulfide, solid-state reaction, crystal structure, band gap
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