A theoretical model for single-molecule incoherent scanning tunneling spectroscopy
@article{Raza2007ATM, title={A theoretical model for single-molecule incoherent scanning tunneling spectroscopy}, author={Hassan Raza}, journal={Journal of Physics: Condensed Matter}, year={2007}, volume={20}, pages={445004} }
Single-molecule scanning tunneling spectroscopy (STS), with dephasing due to elastic and inelastic scattering, is of some current interest. Motivated by this, we report an extended Hückel theory (EHT)-based mean-field non-equilibrium Green’s function (NEGF) transport model with electron–phonon scattering treated within the self-consistent Born approximation (SCBA). Furthermore, a procedure based on EHT basis set modification is described. We use this model to study the effect of the temperature…
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