25 citations · 35 across the 5 of their papers we have counts for
3 papers · 1 filter
Learning Radical Excited States from Sparse Data
Jingkun Shen, Lucy E. Walker, Kevin Ma +4
Emissive organic radicals are currently of great interest for their potential use in the next generation of highly efficient organic light emitting diode (OLED) devices and as mole…
ExROPPP: Fast, Accurate and Spin-Pure Calculation of the Electronically Excited States of Organic Hydrocarbon Radicals
James D. Green, Timothy J. H. Hele
Recent years have seen an explosion of interest in organic radicals due to their promise for highly efficient organic light-emitting diodes (OLEDs) and molecular qubits. However, a…
Inverse molecular design from first principles: tailoring organic chromophore spectra for optoelectronic applications
James David Green, Eric Gabriel Fuemmeler, Timothy J. H. Hele
The discovery of molecules with tailored optoelectronic properties such as specific frequency and intensity of absorption or emission is a major challenge in creating next-generati…