BUG: fix to Castep stress calculation: units in .castep file are GPa, not eV/A^3 (!186) · Merge requests · ase / ase · GitLab

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username-removed-131198 requested to merge jameskermode/ase:castep-stress-fix into master May 19, 2016

Bug fix to Castep.read() routine, which does no unit conversion when parsing stress
Default output unit for Castep stress tensor is GPa, not eV/A^3 as used in ASE