The new P−chalcopyrite compound Cu2FeIn2Se5; synthesis, thermal analysis, and crystal structure analysis by X-ray powder diffraction

Delgado G.E.; Grima-Gallardo P.; Aitken J.A.; Cárdenas A.; Brito, I.

Keywords: Crystal structure; CuInSe2; P, chalcopyrite; Rietveld refinement; X, ray powder diffraction; chemical synthesis; differential thermal analysis; semiconductor

Abstract

The Cu2FeIn2Se5 alloy, belonging to the system (CuInSe2)1-x(FeSe)x; with x = 1/3, was synthesized by the melt and annealing technique. The differential thermal analysis (DTA) indicates that this compound melts at 1017 K. The crystal structure of this new quaternary compound was established using powder X-ray diffraction. Cation distribution analysis indicates that this material crystallizes in a P-chalcopyrite structure, space group P42c (N°112), with unit cell parameters a = 6.1852(2) Å, c = 12.3633(9) Å, V = 472.98(4) Å 3. Cu2FeIn2SeB is a new adamantane type compound derivative of the sphalerite structure, and consists of a three-dimensional arrangement of distorted CuSe4, FeSe4, and InSe4 tetrahedral connected by common faces.

Más información

Título según SCOPUS: The new P−chalcopyrite compound Cu2FeIn2Se5; synthesis, thermal analysis, and crystal structure analysis by X-ray powder diffraction
Título de la Revista: Revista Mexicana de Fisica
Volumen: 67
Número: 1
Editorial: SOCIEDAD MEXICANA DE FISICA
Fecha de publicación: 2021
Página final: 24
Idioma: English
DOI:

10.31349/RevMexFis.67.18

Notas: SCOPUS