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- W2017149576 abstract "We report calculations of the electric-field gradients (EFGs) in pure and doped $text{Ce}M{text{In}}_{5}$ ($M=text{Co}$, Rh, and Ir) compounds and compare with experiment. The degree to which the $text{Ce}text{ }4f$ electron is localized is treated within various models: the local-density approximation, generalized gradient approximation (GGA), $text{GGA}+U$, and $4f$-core approaches. We find that there is a correlation between the observed EFG and whether the $4f$ electron participates in the band formation or not. We also find that the EFG evolves linearly with Sn doping in ${text{CeRhIn}}_{5}$, suggesting the electronic structure is modified by doping. In contrast, the observed EFG in ${text{CeCoIn}}_{5}$ doped with Cd changes little with doping. These results indicate that nuclear quadrupolar resonance is a sensitive probe of electronic structure." @default.
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- W2017149576 date "2008-06-18" @default.
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- W2017149576 title "Probing the electronic structure of pure and doped<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:mtext>Ce</mml:mtext><mml:mi>M</mml:mi><mml:msub><mml:mrow><mml:mtext>In</mml:mtext></mml:mrow><mml:mn>5</mml:mn></mml:msub></mml:mrow></mml:math><mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:mrow><mml:mo>(</mml:mo><mml:mrow><mml:mi>M</mml:mi><mml:mo>=</mml:mo><mml:mtext>Co</mml:mtext><mml:mo>,</mml:mo><mml:mtext>Rh…" @default.
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- W2017149576 doi "https://doi.org/10.1103/physrevb.77.245124" @default.
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