bjmorgan/onetep_utilities
Public repository.
Counts diffusion events in a simulation of a close-packed solid
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Public repository.
Calculates atom localised strain tensors using the approach of Falk and Langer - Phys Rev E 57, 7192 (1998)
Rotates the coordinates for a VASP POSCAR
Statistics for how "tetrahedral" the coordination environment around ions are