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Main Authors: Molinero, Eduardo B., Amorim, Bruno, Ivanov, Misha, Brown, Graham G., Cistaro, Giovanni, Lopes, João M. Viana Parente, Jiménez-Galán, Álvaro, San-Jose, Pablo, Silva, Rui E. F.
Format: Preprint
Published: 2025
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Online Access:https://arxiv.org/abs/2510.22064
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author Molinero, Eduardo B.
Amorim, Bruno
Ivanov, Misha
Brown, Graham G.
Cistaro, Giovanni
Lopes, João M. Viana Parente
Jiménez-Galán, Álvaro
San-Jose, Pablo
Silva, Rui E. F.
author_facet Molinero, Eduardo B.
Amorim, Bruno
Ivanov, Misha
Brown, Graham G.
Cistaro, Giovanni
Lopes, João M. Viana Parente
Jiménez-Galán, Álvaro
San-Jose, Pablo
Silva, Rui E. F.
contents We develop the semiconductor Wannier equations (SWEs), a real-time, real-space formulation of ultrafast light-matter dynamics in crystals, by deriving the equations of motion for the electronic reduced density matrix in a localized Wannier basis. Working in real space removes the structure-gauge ambiguities that hinder reciprocal-space semiconductor Bloch equations. Electron--electron interactions are included at the time-dependent Hartree plus static screened-exchange (TD-HSEX) level. Decoherence is modeled with three complementary channels: pure dephasing, population relaxation, and distance-dependent real-space dephasing; providing physically grounded damping for strong-field phenomena such as high-harmonic generation. Conceptually, the SWEs bridge real-space semiclassical intuition with many-body solid-state optics, offering a numerically robust and gauge-clean alternative to reciprocal-space approaches for nonlinear optical response and attosecond spectroscopy in solids.
format Preprint
id arxiv_https___arxiv_org_abs_2510_22064
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Semiconductor Wannier equations: a real-time, real-space approach to the nonlinear optical response in crystals (ATATA)
Molinero, Eduardo B.
Amorim, Bruno
Ivanov, Misha
Brown, Graham G.
Cistaro, Giovanni
Lopes, João M. Viana Parente
Jiménez-Galán, Álvaro
San-Jose, Pablo
Silva, Rui E. F.
Optics
We develop the semiconductor Wannier equations (SWEs), a real-time, real-space formulation of ultrafast light-matter dynamics in crystals, by deriving the equations of motion for the electronic reduced density matrix in a localized Wannier basis. Working in real space removes the structure-gauge ambiguities that hinder reciprocal-space semiconductor Bloch equations. Electron--electron interactions are included at the time-dependent Hartree plus static screened-exchange (TD-HSEX) level. Decoherence is modeled with three complementary channels: pure dephasing, population relaxation, and distance-dependent real-space dephasing; providing physically grounded damping for strong-field phenomena such as high-harmonic generation. Conceptually, the SWEs bridge real-space semiclassical intuition with many-body solid-state optics, offering a numerically robust and gauge-clean alternative to reciprocal-space approaches for nonlinear optical response and attosecond spectroscopy in solids.
title Semiconductor Wannier equations: a real-time, real-space approach to the nonlinear optical response in crystals (ATATA)
topic Optics
url https://arxiv.org/abs/2510.22064