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SPRING: an effective and reliable framework for image reconstruction in single-particle Coherent Diffraction Imaging

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arxiv 2409.07413 v5 pith:LJIHZO3H submitted 2024-09-11 physics.optics cond-mat.mes-hallphysics.atm-clusphysics.comp-phphysics.data-an

SPRING: an effective and reliable framework for image reconstruction in single-particle Coherent Diffraction Imaging

classification physics.optics cond-mat.mes-hallphysics.atm-clusphysics.comp-phphysics.data-an
keywords diffractionimagingcoherentexperimentalphasespringxfelalgorithms
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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Coherent Diffraction Imaging (CDI) is an experimental technique to gain images of isolated structures by recording the light scattered off the sample. In principle, the sample density can be recovered from the scattered light field through a straightforward Fourier Transform operation. However, only the amplitude of the field is recorded, while the phase is lost during the measurement process and has to be retrieved by means of suitable, well-established phase retrieval algorithms. In this work, we present SPRING, an analysis framework tailored to X-ray Free Electron Laser (XFEL) single-shot single-particle diffraction data that implements the Memetic Phase Retrieval method to mitigate the shortcomings of conventional algorithms. We benchmark the approach on experimental data acquired in two experimental campaigns at SwissFEL and European XFEL. Imaging results on isolated nanostructures reveal unprecedented stability and resilience of the algorithm's behavior on the input parameters, as well as the capability of identifying the solution in conditions hardly treatable so far with conventional methods. A user-friendly implementation of SPRING is released as open-source software, aiming at being a reference tool for the coherent diffraction imaging community at XFEL and synchrotron facilities.

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