Principles and Applications of Density Functional Theory in Inorganic Chemistry I formatIsbn:Softcover - 9783662145388 Franz Röhrenbacher

Franz Röhrenbacher

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Freie Universität Berlin (Islamwissenschaft)

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Principles and Applications of Density Functional Theory in Inorganic Chemistry I formatIsbn:Softcover - 9783662145388 Franz RöhrenbacherJ. Autschbach: The Calculation of NMR Parameters in Transition Metal Complexes. A. Rosa, G. Ricciardi, O. Gritsenko, E. J. Baerends: Excitation Energies of Metal Complexes with Time dependent Density Functional Theory. G. Ujaque, F. Maseras: Applications of Hybrid DFT Molecular Mechanics to Homogeneous Catalysis. J. N. Harvey: DFT Computation of Relative Spin State Energetics of Transition Metal Compounds.