most citedA study of simulating Raman spectra for alkanes with a machine learning-based polarizability model

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physics.chem-ph2023★ 2 cited

A study of simulating Raman spectra for alkanes with a machine learning-based polarizability model

Mandi Fang, Shi Tang, Zheyong Fan +3

Polarizability is closely related to many fundamental characteristics of molecular systems and plays an indispensable role in simulating the Raman spectra. However, the calculation…