Research Data for "TheoDORE: a Toolbox for a Detailed and Automated Analysis of Electronic Excited State Computations" PlasserFelix 2019 ResearchData underlying the manuscript "TheoDORE: a Toolbox for a Detailed and Automated Analysis of Electronic Excited State Computations"<div><br></div><div><u>Content</u></div><div><b>ZMSO2M</b> - input/output files of Turbomole and TheoDORE for the computations on ZMSO2M-14TPA</div><div><b>Irptz2bpy</b> - input/output files of Q-Chem and TheoDORE for the computations on [Ir(ptz)<sub>2</sub>bpy]<sup>+</sup></div><div><b>FQ3F</b> - input/output files of Orca and TheoDORE for the computations on FQ3F</div><div><b>Fig2</b>, <b>Fig3</b>, <b>Fig4-7</b> - raw data and LaTeX/TikZ source files used to create Figures 2-7</div>