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XTANT-3: X-ray-induced Thermal And Nonthermal Transitions in matter: theory, numerical details, user manual

2023/07/08 by Nikita Medvedev, Medvedev, Nikita · 1 citation
Materials Science · Physics and Astronomy · Engineering · #Electron and X-Ray Spectroscopy Techniques #X-ray Spectroscopy and Fluorescence Analysis #Advanced Materials Characterization Techniques

paper · pdf · doi:10.48550/arxiv.2307.03953

Abstract

This is the user manual for the hybrid code XTANT-3, simulating intense femtosecond X-ray irradiation of matter. The code combines a few models into one with feedbacks: transport Monte Carlo simulation, Boltzmann collision integrals, and tight binding molecular dynamics. Such a combination allows the simulation of nonequilibrium, nonadiabatic, and nonthermal effects in electronically excited matter, and the synergy and interplay of these effects. This text contains a description of the theoretical basis of the model and the practical user manual. The detailed description should allow new users, students, and non-specialists to access the ideas behind the code and make the learning curve less steep.

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