Kavli Affiliate: Joseph M. Thijssen | Summary:We have combined ab initio quantum chemistry calculations with a rate-equation formalism to analyze electroluminescence spectra in single-molecule junctions, measured recently by several groups in Scanning Tunneling Microscope setups. In our method, the entire vibrational spectrum is taken into account. Our method leads to good quantitative agreement with both […]
Continue.. Electroluminescence spectra in weakly coupled single-molecule junctions