001     22914
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024 7 _ |a 10.1103/PhysRevB.85.035124
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041 _ _ |a eng
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|a Physics, Condensed Matter
100 1 _ |0 P:(DE-Juel1)139006
|a Flesch, A.
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|u FZJ
245 _ _ |a Orbital-order melting in rare-earth manganites: Role of superexchange
260 _ _ |a College Park, Md.
|b APS
|c 2012
300 _ _ |a 035124
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440 _ 0 |0 4919
|a Physical Review B
|v 85
|x 1098-0121
|y 3
500 _ _ |3 POF3_Assignment on 2016-02-29
500 _ _ |a We thank I. Loa and K. Syassen for sharing unpublished data. Calculations were done on the Julich Blue Gene/P and Juropa. We acknowledge financial support from the Deutsche Forschungsgemeinschaft through research unit FOR1346.
520 _ _ |a We study the mechanism of orbital-order melting observed at temperature T-OO in the series of rare-earth manganites. We find that the purely electronic many-body super-exchange mechanism yields a transition temperature T-KK that decreases with decreasing rare-earth radius and increases with pressure, opposite to the experimental T-OO. We show that the tetragonal crystal-field splitting reduces T-KK further increasing the discrepancies with experiments. This proves that super-exchange effects, although very efficient, in the light of experimentally observed trends play a minor role for the melting of orbital ordering in rare-earth manganites.
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773 _ _ |a 10.1103/PhysRevB.85.035124
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