Element-resolved thermodynamics of magnetocaloric LaFe13–xSix

Gruner, Markus E.; Keune, Werner; Cuenya, B. Roldan; Weis, C.; Landers, Joachim A.; Makarov, S. I.; Klar, David; Hu, M. Y.; Alp, E. E.; Zhao, Jiyong; Krautz, M.; Gutfleisch, O.; Wende, Heiko

doi:10.1103/PhysRevLett.114.057202

Title: Element-resolved thermodynamics of magnetocaloric ${LaFe}_{13 - x} {Si}_{x}$

Journal Article · Wed Feb 04 00:00:00 EST 2015 · Physical Review Letters

DOI:https://doi.org/10.1103/PhysRevLett.114.057202· OSTI ID:1362293

Gruner, Markus E. ^[1]; Keune, Werner ^[2]; Cuenya, B. Roldan ^[3]; Weis, C. ^[4]; Landers, Joachim A. ^[4]; Makarov, S. I. ^[2]; Klar, David ^[4]; Hu, M. Y. ^[5]; Alp, E. E. ^[5]; Zhao, Jiyong ^[5]; Krautz, M. ^[6]; Gutfleisch, O. ^[7]; Wende, Heiko ^[4]

Univ. of Duisburg-Essen, Duisburg (Germany); IFW Dresden, Dresden (Germany)
Univ. of Duisburg-Essen, Duisburg (Germany); Max Planck Institute of Microstructure Physics, Halle (Germany)
Ruhr-Univ. Bochum, Bochum (Germany)
Univ. of Duisburg-Essen, Duisburg (Germany)
Argonne National Lab. (ANL), Argonne, IL (United States)
IFW Dresden, Dresden (Germany)
TU Darmstadt, Darmstadt (Germany)

By combination of two independent approaches, nuclear resonant inelastic x-ray scattering and first-principles calculations in the framework of density functional theory, we demonstrate significant changes in the element-resolved vibrational density of states across the first-order transition from the ferromagnetic low temperature to the paramagnetic high temperature phase of LaFe_13-xSi_x. These changes originate from the itinerant electron metamagnetism associated with Fe and lead to a pronounced magneto-elastic softening despite the large volume decrease at the transition. As a result, the increase in lattice entropy associated with the Fe subsystem is significant and contributes cooperatively with the magnetic and electronic entropy changes to the excellent magneto- and barocaloric properties.

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Research Organization:: Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: Argonne National Laboratory - Advanced Photon Source; USDOE

Grant/Contract Number:: AC02-06CH11357

OSTI ID:: 1362293

Alternate ID(s):: OSTI ID: 1180313

Journal Information:: Physical Review Letters, Vol. 114, Issue 5; ISSN 0031-9007

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 71 works

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Magnetic and magnetocaloric properties of

{({Gd}_{1 - x} Y_{x})}_{2} {NiSi}_{3}

compounds (x = 0.25, 0.5, 0.75)

Journal Article · Sat Apr 06 00:00:00 EDT 2019 · Journal of Magnetism and Magnetic Materials · OSTI ID:1362293

Pakhira, Santanu; Mazumdar, Chandan; Ranganathan, R.

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37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS

Title: Element-resolved thermodynamics of magnetocaloric LaFe 13 – x Si x

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Title: Element-resolved thermodynamics of magnetocaloric ${LaFe}_{13 - x} {Si}_{x}$