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Create lattice-matched stoichiometric interfaces of complex materials

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Make lattice-matched interfaces of complex crystals

Create stoichiometric surfaces of crystals and interfaces between two crystals based on supercell size and lattice match constraints. This package uses ASE to read/write crystal structures and evaluate energies to optimize cuts and stackings in building interfaces. Consequently, any structure formats and interatomic potentials supoprted by ASE can be used with this package. See examples/ for detailed usage examples.

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Create lattice-matched stoichiometric interfaces of complex materials

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