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Two-electron states of a group-V donor in silicon from atomistic full configuration interactions

Two-electron states of a group-V donor in silicon from atomistic full configuration interactions

Two-electron states bound to donors in silicon are important for both two-qubit gates and spin readout. We present a full configuration interaction technique in the atomistic tight-binding basis to capture multielectron exchange and correlation effects taking into account the full band structure of silicon and the atomic-scale granularity of a …