MASAP: a package for atomic scattering amplitude in solids

DOI10.1016/J.CPC.2023.108988MaRDI QIDQ6137357zbMATH OpenFDO

Authors Akihiro Koide, Sara Rabouli, Pierre Le Meur, Sylvain Tricot, Philippe Schieffer, D. Sébilleau, Calogero R. Natoli

Publication date 16 January 2024

Published in Computer Physics Communications (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/J.CPC.2023.108988

zbMATH Keywords

atomic scattering amplitudedifferential cross sectionoptical potentialrelativistic effectssolid state effects

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25) Motion of charged particles (78A35) Covariant wave equations in quantum theory, relativistic quantum mechanics (81R20) (2)-body potential quantum scattering theory (81U05) Inelastic and multichannel quantum scattering (81U35) Atomic physics (81V45) Quantum optics (81V80) Phase transitions (general) in equilibrium statistical mechanics (82B26) Transport processes in time-dependent statistical mechanics (82C70)

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Cited in

(1)

• Relativistic correction of atomic scattering factors for high-energy electron diffraction

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