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Research data for "An analytic linear vibronic coupling method for first-principles spin-dynamics calculations in single-molecule magnets"

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DataCite Commons2022-09-13 更新2025-04-17 收录
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All research data for the paper "An analytic linear vibronic coupling method for first-principles spin-dynamics calculations in single-molecule magnets". <br> Contains: atomic coordinates, spin-phonon coupling parameters, input/output files for calculations.

创建时间:
2022-09-10
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