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Extra info for Optical properties of solids
First, we calculated the single particle energies and orbitals for a few lowest conduction and highest valence band states with zero, one and two electron–hole pairs using a linear combination of bulk Bloch functions as the basis . The single- and two-exciton calculations are iterated to self-consistency. The exciton and two-exciton (biexciton) energies are calculated as the sum of single-particle energies corrected for double counting of the Coulomb interaction. A negative Ebin indicates that the two-exciton emission in PL spectra appears on the higher energy side of the exciton emission.
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