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<p><i>We perform a high-throughput virtual screening using the xTB family of density functional tight-binding methods to map the optoelectronic property space of ~250,000 aromatic molecules and quinone derivatives that find application in organic transistors, solar-cells, thermoelectrics, batteries and photocatalysts. The large volume of data generated allows for a broad understanding of how the presence of a wide range of heteroatoms and functional groups affect the ionisation potential,doi:10.26434/chemrxiv.8950718.v1 fatcat:innarxdwsfei3jvl6lvfonfyhu