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The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

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Quantum Calculation of Molecular Energies and Energy Gradients in Solution by a Conductor Solvent Model

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Absolute hardness: companion parameter to absolute electronegativity

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