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Energetics and dipole moment of transition metal monoxides by quantum Monte Carlo

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Figure

FIG. 1. The energy gain in DMC from using B3LYP orbitals as a function ofthe metal monoxide
TABLE II. Bond length in Å. The statistical uncertainties for the DMCresults of ScO, TiO, VO, CrO, and MnO are, respectively, 0.002, 0.003,0.003, 0.004, and 0.004.

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