Esra Zayim | Searcharxiv

arXiv2026

Inverse Engineering of Optical Constants in Photochromic Micron-Scale Hybrid Films

Photochromic materials enable dynamic optical modulation through reversible transitions between distinct absorption states, with broad potential for smart windows, adaptive optics, and reconfigurable photonic devices. Micron-scale photochromic hybrid films present a particularly attractive platform for these applications, combining straightforward preparation with substantial optical modulation and scalability for high-volume fabrication. However, rational design of such films remains fundamentally constrained by the absence of well-defined optical constants. Unlike homogeneous thin films, micron-scale hybrid photochromic materials comprise active particles dispersed non-uniformly within polymer matrices. Conventional first-principles electromagnetic simulations face substantial computational costs and discrepancies between simulated and experimental particle distributions. Here, we introduce a data-driven framework that extracts effective optical constants directly from minimal experimental transmittance measurements. Our dual-state effective model approximates the complex inhomogeneous photochromic layer as a compressed homogeneous medium characterized by pseudo-refractive indices and pseudo-extinction coefficients for both pristine and UV-irradiated states. Through systematic optimization against experimental data from tungsten oxide-polyvinylpyrrolidone hybrid films, we determine wavelength-dependent pseudo-optical constants and compression ratios that enable accurate prediction of optical modulation within the tested thickness range. Our methodology establishes a framework for engineering hybrid photochromic systems and demonstrates how data-driven modeling can overcome limitations in characterizing complex nanostructured materials.

physics.comp-ph↗

arXiv2025

TMMax: High-performance modeling of multilayer thin-film structures using transfer matrix method with JAX

Optical multilayer thin-films are fundamental components that enable the precise control of reflectance, transmittance, and phase shift in the design of photonic systems. Rapid and accessible simulation of these structures holds critical importance for designing and analyzing complex coatings. While researchers commonly use the traditional transfer matrix method for designing these structures, its scalar approach to wavelength and angle of incidence causes redundant recalculations and inefficiencies in large-scale simulations. Furthermore, traditional method implementations do not support automatic differentiation, which limits their applicability in gradient-based inverse design approaches. Here, we present TMMax, a Python library that fully vectorizes and accelerates transfer matrix method using the high-performance machine learning library JAX. TMMax supports CPU, GPU, and TPU hardware, and includes a publicly available material database. Our approach, demonstrated through benchmarking, allows us to model thin-film stacks with hundreds of layers within seconds. This illustrates that our method achieves a simulation speedup of x100s over a baseline NumPy implementation, enabling optical engineers and thin-film researchers in optics and photonics to efficiently design complex dielectric multilayer structures through rapid and scalable simulations.

physics.comp-ph↗