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v0.5.1

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@jboes jboes released this 26 Jun 15:21
· 36 commits to master since this release
9cab574
  • Bug fix in the conversion between standard and primitive unit cell basis
  • Change of the default settings in slab generation to help people using the SlabGenerator class directly
  • Periodically constrained orthogonalization of the bulk unit cell to help with numerical problems of surface atom identification.