Search Results - "Covito, Fabio"
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Benchmarking nonequilibrium Green’s functions against configuration interaction for time-dependent Auger decay processes
Published in The European physical journal. B, Condensed matter physics (2018)“…We have recently proposed a nonequilibrium Green’s function (NEGF) approach to include Auger decay processes in the ultrafast charge dynamics of photoionized…”
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2
Real-time observation of a correlation-driven sub 3 fs charge migration in ionised adenine
Published in Communications chemistry (20-05-2021)“…Sudden ionisation of a relatively large molecule can initiate a correlation-driven process dubbed charge migration, where the electron density distribution is…”
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3
Nonadiabatic Electron Dynamics in Tunneling Junctions: Lattice Exchange-Correlation Potential
Published in Journal of chemical theory and computation (14-01-2020)“…The search for exchange-correlation functionals going beyond the adiabatic approximation has always been a challenging task for time-dependent…”
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4
Ultrafast dynamics of adenine following XUV ionization
Published in JPhys photonics (01-07-2022)“…Abstract The dynamics of biologically relevant molecules exposed to ionizing radiation contains many facets and spans several orders of magnitude in time and…”
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5
Efficient computation of the second-Born self-energy using tensor-contraction operations
Published 14-10-2019“…J. Chem. Phys. 151, 174110 (2019) In the nonequilibrium Green's function approach, the approximation of the correlation self-energy at the second-Born level is…”
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6
Correlation-driven sub-3 fs charge migration in ionised adenine
Published 14-01-2021“…Sudden ionisation of a relatively large molecule can initiate a correlation-driven process dubbed charge migration, where the electron density distribution is…”
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Journal Article