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Updated: Jun 26, 2026

Magnetometric Characterization of Intermediates in the Solid-State Electrochemistry of Redox-Active Metal-Organic Frameworks
Published on: June 9, 2023
Microscopic understanding of negative magnetization in Cu, Mn, and Fe based Prussian blue analogues
Amit Kumar1, S M Yusuf, L Keller
1Solid State Physics Division, Bhabha Atomic Research Centre, Mumbai 400085, India.
Abstract:
A crossover of the field-cooled magnetization from positive to negative has been observed below the magnetic ordering temperature (17.9 K) in a multimetal Prussian Blue analogue (PBA), Cu_{0.73}Mn_{0.77}[Fe(CN)_{6}].zH_{2}O. The reverse Monte Carlo (RMC) modeling (using the program RMCPOW) has been used to derive the various scattering contributions (e.g., nuclear diffuse, nuclear Bragg, magnetic diffuse, and magnetic Bragg) from the observed neutron diffraction patterns. The RMC analysis combined with the Rietveld refinement technique show an antiferromagnetic ordering of Mn moments with respect to the Cu as well as the Fe moments. Our study gives the first neutron magnetic structure evidence towards the microscopic understanding of the negative magnetization in the PBAs. This information can be effectively utilized to design suitable PBAs for making multifunctional devices.
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