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Synthesis And Structural Studies Of Amido, Hydrazido And Imido Zirconium(Iv) Complexes Incorporating A Diamido/diamine Cyclam-Based Ligand. Dalton Transactions 2009, 7494-7508.
Even-Tempered Slater-Type Orbitals Revisited: From Hydrogen To Krypton. Journal of Computational Chemistry 2004, 25, 1030-1036.
Insights Into The Xenon-Silver Halide Interaction From A Rotational Spectroscopic Study Of Xeagf And Xeagcl. Physical Chemistry Chemical Physics 2004, 6, 3248-3256.
Dft Calculation Of Core-Electron Binding Energies. Journal of Electron Spectroscopy and Related Phenomena 2003, 133, 69-76.
Intermolecular Activation Of Hydrocarbon C-H Bonds Under Ambient Conditions By 16-Electron Neopentylidene And Benzyne Complexes Of Molybdenum. Journal of the American Chemical Society 2003, 125, 7035-7048.
Density-Functional Calculations Of Molecular Electron Affinities. Journal of the Brazilian Chemical Society 1999, 10, 354-358.
Microwave Spectra Of The Ne-N-2 Van Der Waals Complex: Experiment And Theory. Journal of Chemical Physics 1998, 109, 5420-5432.
Accurate Density Functional Calculation Of Core Electron Binding Energies .5. Application To Nitriles. Model Molecules For Polyacrylonitrile Revisited. Journal of Electron Spectroscopy and Related Phenomena 1997, 83, 227-234.
Density Functional Calculations Of Core-Electron Binding Energies Of Amines. Application To (Ch3)(3)N-Ni And (Ch3)(4)N+-Ni. Chemical Physics Letters 1997, 264, 186-192.
Evidencing Intermolecular Effects With Core-Level Photoelectron Spectroscopy Via The Accurate Density Functional Calculation Of Core-Electron Binding Energies On Model Systems: Gamma-Aps As A Test. Journal of Physical Chemistry B 1997, 101, 10254-10261.
Density Functional Calculation Of Core-Electron Binding Energies Of Transition Metal Carbonyl And Nitrosyl Complexes. Chemical Physics Letters 1996, 262, 733-736.
Density Functional Calculation Of Core-Electron Binding Energies Of Glycine Conformers. Canadian Journal of Chemistry-Revue Canadienne De Chimie 1996, 74, 1005-1007.
Accurate Calculation Of Core-Electron Binding-Energies By The Density-Functional Method. Chemical Physics Letters 1995, 232, 486-490.
Density-Functional Calculation Of Core-Electron Binding-Energies Of C, N, O, And F. Journal of Chemical Physics 1995, 103, 1842-1845.
One-Electron Properties Of Several Small Molecules Calculated Using The Local-Density Approximation Within Density-Functional Theory. Journal of Chemical Physics 1995, 102, 3312-3321.
{Local-Density Calculations Of Static Dielectric-Properties Of Ch4-Ncln. Chemical Physics Letters 1994, 217, 539-543.
Comparison Of Local-Density And Hartree-Fock Calculations Of Molecular Polarizabilities And Hyperpolarizabilities. Journal of Chemical Physics 1993, 98, 4753-4765.