Raw data for: "Gradients of ground and excited states for CC2 and ADC(2) in polarizable continuum and atomistic embeddings within a generalized PTED coupling scheme"

The dataset contains the structures, input files, and the output files with the original data for the publication "Gradients of ground and excited states for CC2 and ADC(2) in polarizable continuum and atomistic embeddings within a generalized PTED coupling scheme" by Christof Hättig and Ansgar Pausch.