New non-adiabatic expressions for the partial-FM-occ term yield the most accurate ab initio total energies for carbon polymorphs by incorporating complete EPI physics.
Fan, Temperature dependence of the energy gap in semiconductors, Physical Review82, 900 (1951)
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Accurate computation of the electron-phonon interaction contribution to the total energy
New non-adiabatic expressions for the partial-FM-occ term yield the most accurate ab initio total energies for carbon polymorphs by incorporating complete EPI physics.