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•Using the Hartree–Fock single-excitation configuration interaction (HF-CI) model in conjunction with the local field method, the linear susceptibility tensor, first hypersusceptibility tensor and second hypersusceptibility tensor of the simple cubic (sc) phase of the La@C82 crystal are calculated.•The HF-CI-type electron–phonon model for the La@C82 crystal is solved with site disorder.•The calculations...
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