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New relase 0.1.4

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@zhubonan zhubonan released this 13 Jun 16:23
· 225 commits to main since this release
v0.1.4
8fc881b
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Learn about vigilant mode.

Changes

  • Added support for unfolding CASTEP band structure calculations. This can be activated by passing the --code option in CLI.

Improvement

  • Use time reversal symmetry at more places to reduce the number of supercell kpoints needed to be calculated.
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