Parameterization of magnetic vector potentials and fields for efficient multislice calculations of elastic electron scattering

Lyon, K.; Rusz, J.

doi:10.1107/S2053273321008792

Acta Crystallographica Section A
Acta Crystallographica
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Figure 5
Heatmap of the ratio of the calculated total magnetization versus the expected for a collinear unit cell of b.c.c. iron, using grid spacings ranging from 0.02 to 0.2 Å and with the locations of iron atoms located in the scaled coordinates ranging between $[\langle(0,0,0),(0.5,0.5,0.5)\rangle]$ (shift of 0) and $[\langle(0.45,0.45,0.45),(0.95,0.95,0.95)\rangle]$ (shift of 0.45).

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ISSN: 2053-2733

Volume 77| Part 6| November 2021| Pages 509-518

https://doi.org/10.1107/S2053273321008792

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