Datasets for "Two-dimensional electronic spectroscopy in the condensed phase using equivariant transformer accelerated molecular dynamics simulations"

This upload contains the datasets used in: Two-dimensional electronic spectroscopy in the condensed phase using equivariant transformer accelerated molecular dynamics simulation Joseph Kelly, Frank Hu, Arianna Damiani, Michael S. Chen, Andrew Snider, Minjung Son, Angela Lee, Prachi Gupta, Andrés Montoya-Castillo, Tim J. Zuehlsdorff, Gabriela S. Schlau-Cohen, Christine M. Isborn, and Thomas E. Markland https://doi.org/10.1021/acs.jpclett.5c00911 For file descriptions and usage, please refer to the supplied README.md file.