Fig. 5: Experimental and simulated infrared absorption spectrum and reduced anisotorpic Raman spectra of liquid water under ambient condition. | Nature Communications

Fig. 5: Experimental and simulated infrared absorption spectrum and reduced anisotorpic Raman spectra of liquid water under ambient condition.

From: E(n)-Equivariant cartesian tensor message passing interatomic potential

Fig. 5

a The comparasion of the infrared abosption spectrum b The comparasion of the reduced anisotropic Raman spectra. The black circles are the experimental data44,45, and the lines are calculated with molecular dynamics trajectories performed by HotPP, MB-pol56, DeePMD46,47, and T-EANN42. Source data are provided as a Source Data file.

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