upward, sci

Electron-phonon interaction

H Shang, J Yang, The electron-phonon renormalization in the electronic structure calculation: Fundamentals, current status, and challenges, JCP 158, 130901 (2023)

A P Horsfield, D R Bowler, H Ness, C G Sanchez, T N Todorov, A J Fisher, The transfer of energy between electrons and ions in solids, RPP 69, 1195 (2006)

K Huang, A Rhys, Theory of Light Absorption and Non-Radiative Transitions in F-Centres, Proc Royal Soc 204, 406 (1950)


G Mann, M Rohlfing, T Deilmann, Electron-phonon interaction and band structure renormalization using Gaussian orbital basis sets, PRB 110, 075145 (2024) – doi

F Macheda, P Barone, F Mauri, Electron-Phonon Interaction and Longitudinal-Transverse Phonon Splitting in Doped Semiconductors, PRL 129, 185902 (2022)

C Wang, S Sharma, T Muller, E Gross, J Dewhurst, Coupled Bogoliubov equations for electrons and phonons, PRB 105, 174509 (2022)

W Sio, F Giustino, Unified ab initio description of Frohlich electron-phonon interactions in two-dimensional and three-dimensional materials, PRB 105, 115414 (2022)

H Yang, M Govoni, A Kundu, G Galli, Computational Protocol to Evaluate Electron-Phonon Interactions Within Density Matrix Perturbation Theory, JCTC 18, 6031 (2022)

T Deng, G Wu, W Shi, Z Wong, J Wang, S Yang, Ab initio dipolar electron-phonon interactions in two-dimensional materials, PRB 103, 075410 (2021)

A Miglio, V Brousseau-Couture, E Godbout, G Antonius, Y Chan, S G Louie, M Cote, M Giantomassi, X Gonze, Predominance of non-adiabatic effects in zero-point renormalization of the electronic band gap, npj Comput Mater 6, 167 (2020)

G Brunin, H Miranda, M Giantomassi, M Royo, M Stengel, M Verstraete, X Gonze, G Rignanese, G Hautier, Electron-Phonon beyond Frohlich: Dynamical Quadrupoles in Polar and Covalent Solids, PRL 125, 136601 (2020)

S Ponce, Y Gillet, J L Janssen, A Marini, M Verstraete, X Gonze, Temperature dependence of the electronic structure of semiconductors and insulators, JCP 143, 102813 (2015)

F Giustino, M Cohen, S Louie, Electron-phonon interaction using Wannier functions, PRB 76, 165108 (2007)

R Atta-Fynn, P Biswas, D A Drabold, Electron-phonon coupling is large for localized states, PRB 69, 245204 (2004)

C Furst etal, Quantum kinetic electron-phonon interaction in GaAs: Energy nonconserving scattering events and memory effects, PRL 78, 3733 (1997) – e

P B Allen, M Cardona, Temperature dependence of the direct gap of Si and Ge, PRB 27, 4760 (1983)

Spectroscopy

E Arsenault, P Bhattacharyya, Y Yoneda, G Fleming, Two-dimensional electronic-vibrational spectroscopy: Exploring the interplay of electrons and nuclei in excited state molecular dynamics, JCP 155, 020901 (2021)


P Changala, N Genossar, J Baraban, Franck-Condon spectra of unbound and imaginary-frequency vibrations via correlation functions: A branch-cut free, numerically stable derivation, JCP 157, 124102 (2022)