On Possible States of the Crystal Structure Preceding to a Phase Transition in Zn1 – x V x Se (0.01 ≤ x ≤ 0.10) Crystals

• Published in: Physics of the solid state Vol. 60; no. 12; pp. 2424 - 2435
• Main Authors: Maksimov, V I, Maksimova, E N, Surkova, T P, Vokhmyanin, A P
• Format: Journal Article
• Language: English
• Published: New York Springer Nature B.V 01-01-2018
• Subjects: Basis functions; Correlation analysis; Crystal lattices; Crystal structure; Crystals; Cubic lattice; Deformation; Displacements (lattice); Neutron diffraction; Neutron scattering; Neutrons; Phase transitions; Superstructures; Unit cell; Zinc selenide
• ISSN: 1063-7834; 1090-6460
• DOI: 10.1134/S1063783419010177

The systematic new formations observed in the reciprocal lattice of the cubic structural modification of a II–VI compound are characterized using a detailed neutron diffraction study of bulk semiconducting ZnSe crystals with an increased vanadium content. Direct evidence that the additional sites k = (1/3 1/3 1/3) 2π/a (k is the wave vector and a is cubic unit cell parameter) observed by neutron scattering in the crystals, in the case when they belong to mutually penetrated rotated sublattices, contain a superstructure contribution formed by short-wave deformation, is obtained for the first time. This structure state is determined as a pretransition to the concentration fcc–hcp phase transformation, and the basis functions that allow one to analyze atomic displacements, the correlation between which create distortion-type superstructures, are indicated for the transition through one-arm channel, considering the transitions by the star of wave vector k5 of the fcc lattice.