Advanced theoretical network for modeling light matter interactIon

Livrables

Comparison of TD-DFT, DFTB and macroscopic plasmon lifetimes at the surface of solids with damping.
Improved description of collisions in dielectric materials
Parametrization of optical response of at least 1 band gap material introduced into large scale simulations.
Modified Boltzmann kinetic equation approach incorporating first principles scattering rates
Development of ad hoc models for coupling with macroscopic simulations
Applicability map of each model depending on relevant laser conditions
Modified kinetic-equation electron-phonon-photon schemes in UNC and UBA codes

A web portal with links to codes, tutorials and documentation for the simulation packages, public communication in Marie Curie Alumni Association chapters, public communications
Training of S. Starinskyi on plasmonics of slabs. Training of T. Derrien on DFTB and jellium simulations in Cordoba.

Publications

Photoionization-induced reflection for benchmarking of the photoionization models in solid

Auteurs: Anton Husakou, Zukhriddin Ruziev, Kamoliddin Koraboev, Felipe Morales, Maria Richter, Kazuhiro Yabana
Publié dans: ArXiv, Numéro 2404.08742, 2024, Page(s) 2404.08742, ISSN 2331-8422
Éditeur: Cornell University
DOI: 10.48550/arxiv.2404.08742

Fluorescence in quantum dynamics: accurate spectra require post-mean-field approaches

Auteurs: Bustamante, Carlos M.; Gadea, Esteban D.; Todorov, Tchavdar N.; Horsfield, Andrew; Stella, Lorenzo; Scherlis, Damian A.
Publié dans: J. Chem. Phys., Numéro 158, 2023, Page(s) 144104, ISSN 0021-9606
Éditeur: American Institute of Physics
DOI: 10.1063/5.0142094

Femtosecond Field-Driven On-Chip Unidirectional Electronic Currents in Nonadiabatic Tunneling Regime

Auteurs: Shi, Liping; Babushkin, Ihar; Husakou, Anton; Melchert, Oliver; Frank, Bettina; Yi, Juemin; Wetzel, Gustav; Demircan, Ayhan; Lienau, Christoph; Giessen, Harald; Ivanov, Misha; Morgner, Uwe; Kovacev, Milutin
Publié dans: Laser & Photonics Rev., Numéro 15, 2021, Page(s) 2000475, ISSN 1863-8899
Éditeur: Wiley-VCH GmbH
DOI: 10.1002/lpor.202000475

Photoionization and transient Wannier-Stark ladder in silicon: First principle simulations versus Keldysh theory

Auteurs: Thibault J.-Y. Derrien; Nicolas Tancogne-Dejean; Vladimir P. Zhukov; Heiko Appel; Angel Rubio; Nadezhda M. Bulgakova
Publié dans: Physical Review B, Numéro 104, 2021, Page(s) L241201, ISSN 2469-9969
Éditeur: American Physical Society
DOI: 10.1103/physrevb.104.l241201

Tailoring Cooperative Emission in Molecules: Superradiance and Subradiance from First-Principles Simulations

Auteurs: Carlos M. Bustamante; Esteban D. Gadea; Tchavdar N. Todorov; Damián A. Scherlis
Publié dans: Journal of Physical Chemistry Letters, Numéro 13, 2022, Page(s) 11601, ISSN 1948-7185
Éditeur: American Chemical Society
DOI: 10.1021/acs.jpclett.2c02795

Features of Second Harmonic Generation of Intense Short Laser Pulses in Crystals with a Regular Domain Structure Under Conditions of Self-Action, Nonstationarity, and Synchronism of Group Velocities

Auteurs: Z. J. Ruziev, O. M. Fedotova, O. Kh. Khasanov & U. K. Sapaev
Publié dans: Journal of Applied Spectroscopy, Numéro 88, 2021, Page(s) 514, ISSN 0021-9037
Éditeur: Kluwer Academic Publishers
DOI: 10.1007/s10812-021-01202-7

QM/MM optimization with quantum coupling: Host–guest interactions in a pentacene-doped <i>p</i>-terphenyl crystal

Auteurs: Andrés I. Bertoni; Richard M. Fogarty; Cristián G. Sánchez; Andrew P. Horsfield
Publié dans: J. Chem. Phys., Numéro 156, 2022, Page(s) 044110, ISSN 0021-9606
Éditeur: American Institute of Physics
DOI: 10.1063/5.0079788

Unified model for a nonlinear pulse propagation in composites and optimization of THz generation

Auteurs: A. Husakou; O. Fedotova; R. Rusetsky; O. Khasanov; T. Smirnova; A. Fedotov; T. Apostolova; I. Babushkin; U. Sapaev
Publié dans: Physical Review A, Numéro 108, 2023, Page(s) 013506, ISSN 2469-9926
Éditeur: American Physical Society
DOI: 10.1103/physreva.108.013506

High efficient optical parametric amplification of femtosecond pulses in MgO doped PPLN crystals at 3.4 µm

Auteurs: Sabirov, Obid I.; Sornambigai, G.; Raja, R. Vasantha Jayakantha; Pandiyan, Krishnamoorthy; Sapaev, Usman K.
Publié dans: Opt. Quant. El., Numéro 55, 2023, Page(s) 725, ISSN 1572-817X
Éditeur: Springer
DOI: 10.1007/s11082-023-04990-8

Double-pulse-laser volumetric modification of fused silica: the effect of pulse delay on light propagation and energy deposition

Auteurs: M. Zukerstein,V. P. Zhukov,T. J.-Y. Derrien, O. Fedotova, N. M. Bulgakova
Publié dans: Optics Express, Numéro 32, 2024, Page(s) 12882, ISSN 1094-4087
Éditeur: Optical Society of America
DOI: 10.1364/oe.515766

Efficient Third-Harmonic Generation by Inhomogeneous Quasi-Phase-Matching in Quadratic Crystals

Auteurs: Obid I. Sabirov; Gaetano Assanto; Usman K. Sapaev
Publié dans: Photonics, Numéro 10, 2023, Page(s) 76, ISSN 2304-6732
Éditeur: MDPI
DOI: 10.3390/photonics10010076

Merging of Bi-Modality of Ultrafast Laser Processing: Heating of Si/Au Nanocomposite Solutions with Controlled Chemical Content

Auteurs: Yury V. Ryabchikov, Inam Mirza, Miroslava Flimelová, Antonin Kana, Oleksandr Romanyuk
Publié dans: Nanomaterials, Numéro 14, 2024, Page(s) 321, ISSN 2079-4991
Éditeur: MDPI
DOI: 10.3390/nano14040321

A simple approximation to the electron–phonon interaction in population dynamics

Auteurs: Carlos M. Bustamante, Tchavdar N. Todorov, Cristián G. Sánchez, Andrew Horsfield, Damian A. Scherlis
Publié dans: The Journal of Chemical Physics, Numéro 153, 2023, ISSN 0021-9606
Éditeur: American Institute of Physics
DOI: 10.1063/5.0031766

An excitonic model for the electron–hole plasma relaxation in proton-irradiated insulators

Auteurs: Lorenzo Stella; Jonathan Smyth; Brendan Dromey; Jorge Kohanoff; Jorge Kohanoff
Publié dans: The European Physical Journal D, Numéro 75, 2021, Page(s) 203, ISSN 1434-6060
Éditeur: Springer Verlag
DOI: 10.1140/epjd/s10053-021-00215-3

Radiative thermalization in semiclassical simulations of light-matter interaction

Auteurs: Esteban D. Gadea; Carlos M. Bustamante; Tchavdar N. Todorov; Damián A. Scherlis
Publié dans: Physical Review A, Numéro 105, 2022, Page(s) 42201, ISSN 1094-1622
Éditeur: American Physical Society
DOI: 10.1103/physreva.105.042201

Tunable in situ near-UV pulses by transient plasmonic resonance in nanocomposites

Auteurs: Husakou, Anton; Babushkin, Ihar; Fedotova, Olga; Rusetsky, Ryhor; Smirnova, Tatsiana; Khasanov, Oleg; Fedotov, Alexander; Sapaev, Usman; Apostolova, Tzveta
Publié dans: Optics Express, Numéro 31, 2023, Page(s) 501153, ISSN 1094-4087
Éditeur: Optical Society of America
DOI: 10.1364/oe.501153

Metallic nanostructures as electronic billiards for nonlinear terahertz photonics

Auteurs: Ihar Babushkin, Liping Shi, Ayhan Demircan, Uwe Morgner, Joachim Herrmann, Anton Husakou
Publié dans: Physical Review Research, Numéro 5, 2023, ISSN 2643-1564
Éditeur: American Physical Society
DOI: 10.1103/physrevresearch.5.043151

On the Theoretical Analysis of Parametric Amplification of Femtosecond Laser Pulses in Crystals with a Regular Domain Structure

Auteurs: O. I. Sabirov, D. B. Yusupov, N. A. Akbarova, U. K. Sapaev
Publié dans: NONLINEAR AND PARAMETRIC OPTICS, Numéro 30, 2022, Page(s) 277, ISSN 1934-807X
Éditeur: Springer
DOI: 10.3103/s1541308x22040082

Volumetric Modification of Transparent Materials with Two-Color Laser Irradiation: Insight from Numerical Modeling

Auteurs: V. P. Zhukov, N. M. Bulgakova
Publié dans: Materials, Numéro 17, 2024, Page(s) 1763, ISSN 1996-1944
Éditeur: MDPI Open Access Publishing
DOI: 10.3390/ma17081763

Dissipative Equation of Motion for Electromagnetic Radiation in Quantum Dynamics

Auteurs: Bustamante, Carlos M.; Gadea, Esteban D.; Horsfield, Andrew; Todorov, Tchavdar N.; González Lebrero, Mariano C.; Scherlis, Damián A.
Publié dans: Physical Review Letters, Numéro 126, 2021, Page(s) 87401, ISSN 1079-7114
Éditeur: American Physical Society
DOI: 10.1103/physrevlett.126.087401

Livrables

Publications

Partager cette page

Télécharger