Reliability of bond dissociation enthalpy calculated by the PM6 method and experimental TEAC values in antiradical QSAR of flavonoids

Authors: Dragan Amić and Bono Lučić
Publication year: 2009
Journal / Book title: Bioorganic & Medicinal Chemistry

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Comparison of SCC-DFTB and NDDO-Based Semiempirical Molecular Orbital Methods for Organic Molecules

Authors: Kurt W. Sattelmeyer, Julian Tirado-Rives, and William L. Jorgensen
Publication year: 2007
Journal / Book title: J. Phys. Chem. A

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Calculation of Heat of Formation for Tensile Cyclic Molecules in Condensed Phase Using Electrostatic Potential and QSPR Schemes

Authors: Agata Siwek , Monika Wujeca, Joanna Stefańskab, Piotr Panethc
Publication year: 2008
Journal / Book title: Heteroatom Chemistry

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On the heat of formation of nitromethane

Author(s): John A. Bumpus , Patrick H. Willoughby
Publication year: 2008
Journal / Book title: Journal of Physical Organic Chemistry

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Formation Enthalpies of Ions: Routine Prediction Using Atom Equivalents

Authors: Didier Mathieu and Yohann Pipeau 
Publication year: 2010
Journal / Book title: JOURNAL OF CHEMICAL THEORY AND COMPUTATION

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