Principles of weakly ordered domains in intermetallics: the cooperative effects of atomic packing and electronics in Fe2Al5

Vinokur, A.I.; Hilleke, K.P.; Fredrickson, D.C.

doi:10.1107/S2053273318017461

Acta Crystallographica Section A
Acta Crystallographica
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Figure 9
DFT-CPs underlying channel formation in Fe₂Al₅. The CPs experienced by the Fe and Al2 atom sites are shown in three ordered models: (a) Model 2, (b) Model 3 and (c) Model 1. A persistent feature is the presence of negative CP along the Al2 channel.

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ISSN: 2053-2733

Volume 75| Part 2| March 2019| Pages 297-306

https://doi.org/10.1107/S2053273318017461

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