Luis A. Agapito

activity

20112018

most citedEffective and accurate representation of extended Bloch states on finite Hilbert spaces

85 citations · 556 across the 12 of their papers we have counts for

collaborators

Showing 2016Show all

2 papers · 1 filter

cond-mat.mtrl-sci2016★ 40 cited

Accurate $ab ini t i o$ tight-binding Hamiltonians: effective tools for electronic transport and optical spectroscopy from first principles

Pino D'Amico, Luis A. Agapito, Alessandra Catellani +5

The calculations of electronic transport coefficients and optical properties require a very dense interpolation of the electronic band structure in reciprocal space that is computa…

cond-mat.mtrl-sci2016★ 59 cited

Accurate Tight-Binding Hamiltonians for 2D and Layered Materials

Luis Agapito, Marco Fornari, Davide Ceresoli +3

We present a scheme to controllably improve the accuracy of tight-binding Hamiltonian matrices derived by projecting the solutions of plane-wave ab initio calculations on atomic or…

Accurate ab initio tight-binding Hamiltonians: effective tools for electronic transport and optical spectroscopy from first principles

Accurate Tight-Binding Hamiltonians for 2D and Layered Materials

Accurate $ab ini t i o$ tight-binding Hamiltonians: effective tools for electronic transport and optical spectroscopy from first principles