Open access
Aug 2026
Quantum-Enhanced Machine Learning Framework for Photocatalytic Materials Discovery: Integrating Quantum Chemical Descriptors and Many-Body Electronic Structure Theory
The quantum-mechanical findings show that many body interactions, such as exciton dissociation dynamics and the contribution of quantum tunneling to charge transfer, can predict photocatalytic responses in new emerging quantum materials.
Sandeep Gupta, Kanad Ray, Miller Toledo-Solano et al.
· Materials for Quantum Techno... · 0 citations