The transformation matrices (distortion, orientation, correspondence), their continuous forms and their variants

Acta Crystallogr A Found Adv. 2019 May 1;75(Pt 3):411-437. doi: 10.1107/S205327331900038X. Epub 2019 Apr 10.

Abstract

The crystallography of displacive/martensitic phase transformations can be described with three types of matrix: the lattice distortion matrix, the orientation relationship matrix and the correspondence matrix. Given here are some formulae to express them in crystallographic, orthonormal and reciprocal bases, and an explanation is offered of how to deduce the matrices of inverse transformation. In the case of the hard-sphere assumption, a continuous form of distortion matrix can be determined, and its derivative is identified to the velocity gradient used in continuum mechanics. The distortion, orientation and correspondence variants are determined by coset decomposition with intersection groups that depend on the point groups of the phases and on the type of transformation matrix. The stretch variants required in the phenomenological theory of martensitic transformation should be distinguished from the correspondence variants. The orientation and correspondence variants are also different; they are defined from the geometric symmetries and algebraic symmetries, respectively. The concept of orientation (ir)reversibility during thermal cycling is briefly and partially treated by generalizing the orientation variants with n-cosets and graphs. Some simple examples are given to show that there is no general relation between the numbers of distortion, orientation and correspondence variants, and to illustrate the concept of orientation variants formed by thermal cycling.

Keywords: correspondence; distortion; martensitic transformation; orientation; phase transformations; transformation matrices; variants.