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AOMix : software for molecular orbital and electron population analysis. It allows the population analysis per molecular orbital and condensed Fukui functions; analysis of overlap populations between molecular fragments; the Lowdin population analysis (LPA); calculation of atomic/fragment total and free valence indices, two-center (Wiberg, Lowdin, and Mayer), and three-, four-, five- and six-center bond orders; probing of molecular orbital contributions to bonding using orbital occupancy-perturbed Mayer bon
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