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The 0.3 d electron missing is d3 z2 -1, which extends in the z direction, beyond the sphere. In our three-band model, this orbital is downfolded into the tails of the Op orbitals (Ref.).
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The 0.3 d electron missing is d3 z2 -1, which extends in the z direction, beyond the sphere. In our three-band model, this orbital is downfolded into the tails of the Op orbitals (Ref.).
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Using a two-hopping parameter model, we find Tc variatons of 1% for ep - ed =3.5 and 4.79 eV.
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