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024 7 _ |a 10.1103/PhysRevB.75.104406
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|a Physics, Condensed Matter
100 1 _ |a Di Napoli, S.
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245 _ _ |a Magnetic order in RMn2Ge2 (R=Y,Ca) compounds and their solid solutions with LaMn2Ge2
260 _ _ |a College Park, Md.
|b APS
|c 2007
300 _ _ |a 104406
336 7 _ |a Journal Article
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440 _ 0 |a Physical Review B
|x 1098-0121
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500 _ _ |a Record converted from VDB: 12.11.2012
520 _ _ |a We present a systematic study of the stability of the collinear and noncollinear magnetic states of RMn2Ge2 (R=Y,Ca) compounds as a function of the lattice parameter so as to simulate alloying with La, using density-functional theory calculations. The results allow us to discriminate between chemical and structural factors that determine the magnetic properties of these systems. We find that, to a large extent, the magnetic moments are determined by the interatomic Mn-Mn distance, given by the size of the substitutional atom. We also find that the different magnetic structures appearing along the phase diagrams are to be mainly ascribed to the interstitial electronic density related to the divalent or trivalent character of the R atom.
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700 1 _ |a Llois, A. M.
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700 1 _ |a Bihlmayer, G.
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700 1 _ |a Blügel, S.
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773 1 8 |a 10.1103/physrevb.75.104406
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|t Physical Review B
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773 _ _ |a 10.1103/PhysRevB.75.104406
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856 7 _ |u http://dx.doi.org/10.1103/PhysRevB.75.104406
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999 C 5 |a 10.1016/j.jmmm.2006.06.010
|9 -- missing cx lookup --
|2 Crossref
999 C 5 |a 10.1103/PhysRevB.69.174432
|9 -- missing cx lookup --
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999 C 5 |a 10.1016/0925-8388(96)02310-9
|9 -- missing cx lookup --
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999 C 5 |a 10.1016/S0925-8388(97)00487-8
|9 -- missing cx lookup --
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999 C 5 |a 10.1103/PhysRevB.70.174418
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999 C 5 |a 10.1016/S0304-8853(98)00147-4
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999 C 5 |a 10.1016/0925-8388(94)90141-4
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999 C 5 |a 10.1088/0022-3719/5/13/012
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999 C 5 |1 V. L. Moruzzi
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|t Calculated Electronic Properties of Metals
|o V. L. Moruzzi Calculated Electronic Properties of Metals 1978
999 C 5 |a 10.1103/PhysRevB.67.140406
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999 C 5 |a 10.1103/PhysRevB.69.024415
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999 C 5 |a 10.1103/PhysRevB.24.864
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999 C 5 |a 10.1103/PhysRevB.26.4571
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999 C 5 |1 C. Herring
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|2 Crossref
|t Magnetism
|o C. Herring Magnetism 1966
999 C 5 |a 10.1080/000187398243573
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999 C 5 |a 10.1016/0925-8388(94)90140-6
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999 C 5 |1 J. B. Goodenough
|y 1966
|2 Crossref
|t Magnetism and the Chemical Bond
|o J. B. Goodenough Magnetism and the Chemical Bond 1966


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