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000055333 084__ $$2WoS$$aPhysics, Condensed Matter
000055333 1001_ $$0P:(DE-Juel1)130881$$aPavarini, E.$$b0$$uFZJ
000055333 245__ $$aFirst-principles study of spin-orbit effects and NMR in Sr2RuO4
000055333 260__ $$aCollege Park, Md.$$bAPS$$c2006
000055333 300__ $$a035115
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000055333 440_0 $$04919$$aPhysical Review B$$v74$$x1098-0121
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000055333 520__ $$aWe present a first principles study of nuclear magnetic resonance (NMR) and spin orbit effects in the unconventional superconductor Sr2RuO4. We have calculated the uniform magnetic susceptibility, which agrees rather well with the experiment in amplitude, but, as in an earlier model result we found the calculated hard axis to be z, opposite to the experiment. We have also calculated the Knight shifts and the NMR relaxation rates for all atoms, and again found an overall good agreement, but with important deviations from the experiment in the same particular characteristics, such as the Knight shift anisotropy. Our results suggest that correlations in Sr2RuO4 lead to underestimations of the orbital effects in density-functional-based calculations. We also argue that the accepted "experimental" value for the relative contribution of orbital polarization in susceptibility, 10-15 %, is also an underestimation. We discuss the puzzling invariance of the O and Ru Knight shifts across the superconducting transition for all directions of the applied field. We show that this fact cannot be explained by accidental cancellations or spin-flip scattering, as it happens in some elemental superconductors. We also point out that a large contribution of the dipole and orbital hyperfine field into the Knight shifts in Sr2RuO4, combined with the possibility of an orbital-dependent superconductivity, calls for a revision of the standard theory of the Knight shift in the superconducting state.
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000055333 7001_ $$0P:(DE-HGF)0$$aMazin, I.I.$$b1
000055333 77318 $$2Crossref$$3journal-article$$a10.1103/physrevb.74.035115$$bAmerican Physical Society (APS)$$d2006-07-24$$n3$$p035115$$tPhysical Review B$$v74$$x1098-0121$$y2006
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000055333 8567_ $$uhttp://dx.doi.org/10.1103/PhysRevB.74.035115
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000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.75.657
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.80.161
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.95.217004
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.47.331
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/25315
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.63.060507
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.85.5412
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/29038
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.93.167004
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.63.239
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1143/JPSJ.66.1405
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.72.144528
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRev.106.208
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRev.121.779
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.36.177
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.3.262
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.3.325
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.3.323
000055333 999C5 $$1D. E. MacLaughlin$$2Crossref$$9-- missing cx lookup --$$a10.1016/S0081-1947(08)60541-X$$p2 -$$tSolid State Phys.$$v31$$y1976
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1209/epl/i2000-00173-x
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.50.17910
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.51.1385
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.52.1358
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.79.733
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.53.2571
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.62.R16219
000055333 999C5 $$1O. K. Andersen$$2Crossref$$oO. K. Andersen Electronic Structure and Physical Properties of Solids. The Uses of the LMTO Method 2000$$tElectronic Structure and Physical Properties of Solids. The Uses of the LMTO Method$$y2000
000055333 999C5 $$1P. Blaha$$2Crossref$$oP. Blaha Wien2k-05, an Augmented Plane Wave+Local Orbitals Program for Calculating Crystal Properties$$tWien2k-05, an Augmented Plane Wave+Local Orbitals Program for Calculating Crystal Properties
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/1367-2630/7/1/188
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.56.R505
000055333 999C5 $$1Ziman$$2Crossref$$9-- missing cx lookup --$$a10.1017/CBO9781139644075$$y1972
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.69.020402
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.64.140504
000055333 999C5 $$1I. I. Mazin$$2Crossref$$oI. I. Mazin Proceedings of the NATO ARW on Physics of Spin in Solids: Materials, Methods and Applications 2003$$tProceedings of the NATO ARW on Physics of Spin in Solids: Materials, Methods and Applications$$y2003
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.71.100503
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.289.5480.746
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.64.180502
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.70.134520
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.84.5387
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.81.3006
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1143/JPSJ.67.3945
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.72.1933
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/7/47/002
000055333 999C5 $$1M. Sigrist$$2Crossref$$9-- missing cx lookup --$$a10.1016/S0921-4534(99)00053-2$$p134 -$$tPhysica C$$v317–318$$y1999
000055333 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.66.064522