Reference Label | Details |
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est unc | estimated uncertainty |
Schwerdtfeger 2011 | C. A. Schwerdtfeger, A. E. DePrince III, and D. A. Mazziotti, J. Chem. Phys. 134, 174102/1-10 (2011) Testing the Parametric Two-Electron Reduced-Density-Matrix Method with Improved Functionals: Application to the Conversion of Hydrogen Peroxide to Oxywater |
Hoy 2012 | E. P. Hoy, C. A. Schwerdtfeger, and D. A. Mazziotti, Mol. Phys. 110, 765-773 (2012) Isoelectronic Analogue of Oxywater: A Parametric Two-Electron Reduced-Density-Matrix Study of Ammonia Oxide |