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A generalized any-particle propagator theory: Prediction of proton affinities and acidity properties with the proton propagator
We have recently extended the electron propagator theory to the treatment of any type of particle using an Any-Particle Molecular Orbital (APMO) wavefunction as reference state. This approach, called APMO/PT, has been ...
Double Rydberg anions with solvated ammonium kernels: Electron binding energies and Dyson orbitals
Ab initio electron-propagator calculations on the electron detachment energies and associated Dyson orbitals of NnH3n+1- for n = 1-5 confirm the assignment of low-energy peaks in anion photoelectron spectra to double Rydberg ...