Improved reaction and activation energies of [4+2] cycloadditions, [3,3] sigmatropic rearrangements and electrocyclizations with the spin-component- scaled MP2 method

T. P.M. Goumans, Andreas W. Ehlers, Koop Lammertsma, Ernst Ulrich Würthwein, Stefan Grimme

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79 Citations (Scopus)

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Chemistry