Spin-density fluctuations and the fluctuation-dissipation theorem in 3d ferromagnetic metals

Wysocki, Alex L.; Valmispild, V. N.; Kutepov, A.; Sharma, S.; Dewhurst, J. K.; Gross, E. K. U.; Lichtenstein, A. I.; Antropov, V. P.

doi:10.1103/PhysRevB.96.184418

Title: Spin-density fluctuations and the fluctuation-dissipation theorem in $3 d$ ferromagnetic metals

Journal Article · Wed Nov 15 00:00:00 EST 2017 · Physical Review B

DOI:https://doi.org/10.1103/PhysRevB.96.184418· OSTI ID:1410345

Wysocki, Alex L. ^[1]; Valmispild, V. N. ^[2]; Kutepov, A. ^[3]; Sharma, S. ^[4]; Dewhurst, J. K. ^[4]; Gross, E. K. U. ^[4]; Lichtenstein, A. I. ^[2]; Antropov, V. P. ^[1]

Ames Lab., Ames, IA (United States)
Univ. of Hamburg, Hamburg (Germany); The Hamburg Centre for Ultrafast Imaging, Hamburg (Germany)
Ames Lab., Ames, IA (United States); Brookhaven National Lab. (BNL), Upton, NY (United States)
Max Planck Institute of Microstructure Physics, Halle (Germany)

Spatial and time scales of spin-density fluctuations (SDFs) were analyzed in 3d ferromagnets using ab initio linear-response calculations of complete wave-vector and energy dependence of the dynamic spin susceptibility tensor. We demonstrate that SDFs are spread continuously over the entire Brillouin zone and while the majority of them reside within the 3d bandwidth, a significant amount comes from much higher energies. A validity of the adiabatic approximation in spin dynamics is discussed. The SDF spectrum is shown to have two main constituents: a minor low-energy spin-wave contribution and a much larger high-energy component from more localized excitations. Furthermore, using the fluctuation-dissipation theorem, the on-site spin correlator and the related effective fluctuating moment were properly evaluated and their universal dependence on the 3d band population is further discussed.

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Research Organization:: Ames Laboratory (AMES), Ames, IA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC02-07CH11358

OSTI ID:: 1410345

Alternate ID(s):: OSTI ID: 1408933

Report Number(s):: IS-J-9506; PRBMDO

Journal Information:: Physical Review B, Vol. 96, Issue 18; ISSN 2469-9950

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 10 works

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Spin-fluctuation and spin-relaxation effects of single adatoms from first principles Ibañez-Azpiroz, Julen; dos Santos Dias, Manuel; Blügel, Stefan Journal of Physics: Condensed Matter, Vol. 30, Issue 34 https://doi.org/10.1088/1361-648x/aad43d	journal	August 2018
Spin dynamics from time-dependent density functional perturbation theory Gorni, Tommaso; Timrov, Iurii; Baroni, Stefano The European Physical Journal B, Vol. 91, Issue 10 https://doi.org/10.1140/epjb/e2018-90247-9	journal	October 2018
Spin dynamics from time-dependent density functional perturbation theory Gorni, Tommaso; Timrov, Iurii; Baroni, Stefano arXiv https://doi.org/10.48550/arxiv.1804.06573	text	January 2018
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Theoretical prediction of a highly responsive material: Spin fluctuations and superconductivity in FeNiB2 system Wang, Renhai; Sun, Yang; Antropov, Vladimir arXiv https://doi.org/10.48550/arxiv.1908.01025	text	January 2019

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