DNA-Templated Dye Aggregates for Quantum Entanglement and Quantum Information Applications
Various dyes are computationally screened using a combination of ab-initio, molecular dynamics and machine learning methods. We predict their ground state and excited state properties, reveal dye structure feature-property relationships to fundamentally understand quantum entanglement, and explore hydrophobicity and polarity effects on dyes for quantum coherent exciton devices.
In collaboration with the Quantum DNA Research Group