Tuesday 10 January 2012

Magnetic structure from ab initio reversed MC

Empirical Magnetic Structure Solution of Frustrated Spin Systems.
Joseph A. M. Paddison and Andrew L. Goodwin
Phys. Rev. Lett. 108, 017204 (2012)
Summary of results for frustrated magnets. (a) Heisenberg pyrochlore antiferromagnet; (b) ‘‘hexagonal
spin cluster’’ spinel ZnCr2O4; (c) GGG; (d) hyperkagome Na4Ir3O8; (e) extended kagome YBaCo4O7; (f ) kagome XY system; (g) kagome Ising system. The left-hand column shows the RMC fit to simulated powder diffraction data (calculation
details given in Ref. [12]). Input data are shown in black, RMC fit in red, and difference (RMC data) in blue.

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