Browsing by Author Stiakaki, M.-A. D.

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Showing results 1 to 7 of 7
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Ground and Excited State Properties of the Cationic and Anionic First Row Transition- Metal Oxide Diatomics Calculated by an Improved ASED-MO ModelBakalbassis, E. G.; Stiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
Ground and low-lying excited state properties of the first-row transition-metal oxide diatomics calculated by an improved ASED-MO modelBakalbassis, E. G.; Stiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
Molecular Geometries and Energetics of Metal-Containing Systems Using a Modified Extended HΕ±ckel Molecular Orbital Method: A Systematic Test to 1 and 2 Group Metal-Containing Systems in the Gas-PhaseStiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.; Xanthopoulos, C. E.24-Nov-2015-
Spectroscopic Constants and Energetics of Metal-containing Systems. Experiment for the Undergraduate Computational Chemistry LaboratoryBakalbassis, E. G.; Stiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
Theoretical Aspects of Methane Chemisorption on MgO Surfaces. Modeling of Impurityinduced Trapping of a Hole, Surface Defects and Site Dependence of Methane Chemisorption on (MgO)9,12 ClustersStiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.; Xanthopoulos, C. E.24-Nov-2015-
Theoretical aspects of methane dissociation and hydroxylation on metal oxide diatomics in the gas phaseStiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.; Xanthopoulos, C. E.24-Nov-2015-
Theoretical Study of Methane Activation by Gas-Phase Cationic Main Group Metal Oxide DiatomicsStiakaki, M.-A. D.; Tsipis, A. C.; Tsipis, C. A.; Xanthopoulos, C. E.24-Nov-2015-