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    Anisotropic dielectric function of X-, Y-128∘, and Z-Cut LiNbO3 crystals from combined infrared ellipsometry, Raman, and reflectance spectroscopy

    A. Santos-Amador1,*, J. Puebla2,3, O. Del Pozo-Zamudio1, and R. E. Balderas-Navarro1

    • *Contact author: armando.sa.amador@gmail.com

    Phys. Rev. Materials 10, 095202 – Published 15 September, 2026

    DOI: https://doi.org/10.1103/1pyn-j9jx

    Abstract

    Lithium niobate (LiNbO3) is a key anisotropic material for midinfrared photonics, nonlinear optics, and acousto-optic applications, where accurate dielectric function (DF) models are required for optical simulations under arbitrary crystallographic orientations. In this work, an anisotropic DF model for commercial X-, Y-128∘, and Z-cut LiNbO3 substrates is developed in the infrared (IR) spectral range using a factorized transverse optical and longitudinal optical (TO-LO) formalism. The model is obtained through spectroscopic ellipsometry (SE) supported by polarized Raman spectroscopy and IR reflectance measurements. These complementary techniques enable the identification and cross-validation of phonon modes associated with the in-plane E(x) and out-of-plane A1(z) components of the dielectric tensor (DT). A single parametrized DT consistently reproduces the optical response of all analyzed crystal cuts through appropriate Euler-angle rotations, including different azimuthal configurations that exhibit distinct birefringent responses. The proposed approach provides a Kramers-Kronig consistent description of the dielectric response through a physically constrained parametrization, reducing parameter correlations during optical modeling. The resulting DF is presented in analytical form over the 230−1200cm−1 spectral range and is directly applicable to integrated photonics, acousto-optic, and nonlinear optical device simulations in the IR.

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