2019
DOI: 10.3390/condmat4040086
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Mössbauer Spectroscopy of Triphylite (LiFePO4) at Low Temperatures

Abstract: Low temperature magnetic ordering in the LiFePO 4 compound is investigated experimentally using Mössbauer spectroscopy and theoretically via first principles calculations. The evaluation of experiment carried out on a powder sample is compatible with an antiferromagnetic order of Fe ion magnetic moments. When an external magnetic field is applied, Fe magnetic moments start to deviate slightly from the [010] easy magnetization direction. These findings are confirmed by means of first principles calculat… Show more

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Cited by 7 publications
(3 citation statements)
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“…Additionally, the magnetic moment per was determined using the Curie–Weiss law, which can be used for superparamagnetic nanoparticles in the case of high temperature in the form of: where C is the Curie constant, T is the thermodynamic temperature, is the susceptibility and is the Weiss constant. The Curie constant thus serves to calculate the magnetic moment per via the next equation: where represents the vacuum permeability and the Boltzmann constant [ 38 ]. The fitted Curie constant, Weiss constant and calculated values of magnetic moment per are presented in Table 6 .…”
Section: Resultsmentioning
confidence: 99%
“…Additionally, the magnetic moment per was determined using the Curie–Weiss law, which can be used for superparamagnetic nanoparticles in the case of high temperature in the form of: where C is the Curie constant, T is the thermodynamic temperature, is the susceptibility and is the Weiss constant. The Curie constant thus serves to calculate the magnetic moment per via the next equation: where represents the vacuum permeability and the Boltzmann constant [ 38 ]. The fitted Curie constant, Weiss constant and calculated values of magnetic moment per are presented in Table 6 .…”
Section: Resultsmentioning
confidence: 99%
“…The latter can be viewed as a cousin technique of Compton scattering, involving γ-rays instead of hard X-rays, allowing the identification of defects (that are often attractive for positrons) and their chemical surroundings in materials [22,23]. DFT-based simulations in conjunction with Mössbauer spectroscopy, moreover, can be applied to study the deep connection between magnetism, electronic, and atomic structure in cathode materials [24] allowing the identification of the redox state of cathodes. DFT-based simulations are also able to provide precious information regarding the effect of the local atomic environment and structural deformations on the electrochemical redox potentials [17].…”
Section: Advanced Battery Characterisationmentioning
confidence: 99%
“…Shirley Shen's group proposed a MOF based on Fe called Matériaux de l' Institut Lavoisier 101 [MIL-101(Fe)] as a cathode material for Li-ion batteries, in 2015 [12]. Shin et al [12] found that the Fe 3+ /Fe 2+ redox pair is active in MIL-101(Fe), as is the case in the well-known olivine LiFePO 4 material [13][14][15][16]. However, reversibility of this MOF degraded rapidly with cycling, so that appropriate functionalization of MIL-101(Fe) will be needed to address this problem [12].…”
Section: Introductionmentioning
confidence: 99%