This Python script can be used to compute several properties of crystals including but not limited to the group theoretical analysis such as structural decompositions, symmetry adapted mode amplitude calculations, and polarizations using Born effective charges.
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This Python script can be used to compute several properties of crystals including but not limited to the group theoretical analysis such as structural decompositions, symmetry adapted mode amplitude calculations, and polarizations using Born effective charges.
nabin88/structural_mode_decompositions
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This Python script can be used to compute several properties of crystals including but not limited to the group theoretical analysis such as structural decompositions, symmetry adapted mode amplitude calculations, and polarizations using Born effective charges.
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