2 papers
quant-ph2026
Auger Spectroscopy via Generative Quantum Eigensolver: A Quantum Approach to Molecular Excitations
Kimberlee Keithley, Shunsuke Yamamoto, Ryota Kenmoku +16
Auger electron spectroscopy, a way of characterizing electronic structure through core-level decay processes, is widely used in materials characterization; however direct calculati…
cs.LG2026
Coupled Cluster con MÅLe: Molecular Orbital Learning for Neural Wavefunctions
Luca Thiede, Abdulrahman Aldossary, Andreas Burger +9
Density functional theory (DFT) is the most widely used method for calculating molecular properties; however, its accuracy is often insufficient for quantitative predictions. Coupl…