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Extending the capillary wave model to include the effect of bending rigidity: X-ray reflectivity and diffuse scattering

Chen Shen (沈辰)1,*, Honghu Zhang (张洪湖)2, Beate Klösgen1,3, and Benjamin M. Ocko2,†

  • *Contact author: chen.shen@desy.de
  • †Contact author: ocko@bnl.gov

Phys. Rev. Research 7, 043016 – Published 3 October, 2025

DOI: https://doi.org/10.1103/znt1-fmx6

Abstract

The surface roughness of a thin film at a liquid interface exhibits contributions of thermally excited fluctuations. This thermal roughness depends on temperature (T), surface tension (γ), and elastic material properties, specifically the bending modulus (κ) of the film. A nonzero κ suppresses the thermal roughness at small length scales compared to an interface with zero κ, as expressed by the power spectral density of the thermal roughness. The description of the x-ray scattering of the standard capillary wave model (CWM), which is valid for zero κ, is extended to include the effect of κ. The extended CWM (eCWM) provides a single analytical form for both the specular x-ray reflectivity (XRR) and the diffuse scattering around the specular reflection, and recovers the expression of the CWM at its zero κ limit. This theoretical approach enables the use of single-shot grazing incidence x-ray off-specular scattering (GIXOS) measurements for characterizing the structure of thin films on a liquid surface. The eCWM analysis approach decouples the thermal roughness factor from the surface scattering signal, providing direct access to the intrinsic surface-normal structure of the film and its bending modulus. Moreover, the eCWM facilitates the calculation of reflectivity at any desired resolution (pseudo-XRR approach). The transformation into pseudo-XRR provides the benefit of using widely available XRR software to perform GIXOS analysis. The extended range of the vertical scattering vector (Qz) available with the GIXOS pseudo-XRR approach allows for a higher spatial resolution than with conventional XRR. Experimental results are presented for various lipid systems, showing strong agreement between conventional specular XRR and pseudo-XRR methods. This agreement validates the proposed approach and highlights its utility for analyzing soft, thin films.

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