2013
DOI: 10.1021/ic4009653
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β-Mn-Type Co8+xZn12–x as a Defect Cubic Laves Phase: Site Preferences, Magnetism, and Electronic Structure

Abstract: The results of crystallographic analysis, magnetic characterization, and theoretical assessment of β-Mn-type Co-Zn intermetallics prepared using high-temperature methods are presented. These β-Mn Co-Zn phases crystallize in the space group P4(1)32 [Pearson symbol cP20; a = 6.3555(7)-6.3220(7)], and their stoichiometry may be expressed as Co(8+x)Zn(12-x) [1.7(2) < x < 2.2(2)]. According to a combination of single-crystal X-ray diffraction, neutron powder diffraction, and scanning electron microscopy, atomic sit… Show more

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Cited by 38 publications
(41 citation statements)
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References 53 publications
(78 reference statements)
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“…We thus conclude that in Co 8 Zn 8 Mn 3 Fe the Fe ion entirely occupies the 12d-sites, together with Mn and Zn, while Co occupies the 8c-site. Comparing our fit result with previous reports (see [13]), we find good agreement regarding atomic coordinates. The rather large B iso values of the 12d sites suggest some strain disorder on this site, likely as result of the doping [19].…”
Section: Neutron Diffractionsupporting
confidence: 89%
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“…We thus conclude that in Co 8 Zn 8 Mn 3 Fe the Fe ion entirely occupies the 12d-sites, together with Mn and Zn, while Co occupies the 8c-site. Comparing our fit result with previous reports (see [13]), we find good agreement regarding atomic coordinates. The rather large B iso values of the 12d sites suggest some strain disorder on this site, likely as result of the doping [19].…”
Section: Neutron Diffractionsupporting
confidence: 89%
“…Polycrystalline samples of the pseudoternary compound Co 8 Zn 8 Mn 4−x Fe x with x=0, 0.2, 0.35, 0.5, and 1 as well as a Co 8 Zn 9 Mn 3 specimen were synthesized by a thermal reaction similar as described in [13]. Stoichiometric amounts of Co (Chempur, 99.95%), Zn (Koch, 99.999 8%), Mn (Chempur, 99.99%), and Fe (Alfa Aesar, 99.98%) were sealed in an evacuated quartz tube (p<10 −5 mbar), heated to 1100°C for 12 hours and cooled down to 925°C with a cooling rate of 1K h −1 .…”
Section: Sample Preparationmentioning
confidence: 99%
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