CHBC Faculty Publications

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Author: Sellers, Harrell Lee

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TitlePublication NamePub. TypeYear
Calculations for Bridge and on-Top Co on Pd[110]Abstracts of Papers of the American Chemical SocietyAbstract1992
Consistent Generalization of the Moller-Plesset Partitioning to Open-Shell and Multiconfigurational Scf Reference States in Many-Body Perturbation-TheoryChemical Physics LettersJournal Article1987
The Ring Puckering Potential of Oxetane - Local Correlation ResultsChemical Physics LettersJournal Article1986
Analytical Force-Constant Calculation as a Minimization Problem.International Journal of Quantum ChemistryJournal Article1986
The effect of inner-shell polarization on diagonal stretching force constants. Part III. ACCD results for hydrogen fluoride, hydroxide ion, ammonia, nitrogen, fluorine and formaldehyde.Journal of Molecular Structure-TheochemJournal Article1986
The Adiabatic Correction to Molecular-Potential Surfaces in the Scf ApproximationChemical Physics LettersJournal Article1984
Abinitio Studies of Structural Features Not Easily Amenable to Experiment .22. Structural Aspects of a Long-Chain Hydrocarbon (Normal-Nonane) and a Study of the Transferability of Electronic Effects through C - C Single BondsJournal of Computational ChemistryJournal Article1982
Abinitio Studies of Structural Features Not Easily Amenable to Experiment .15. The Influence of Solvation on Molecular-Structure in Some Formic-Acid and Carbonic-Acid Hydrates.Journal of Molecular Structure-TheochemJournal Article1982
Abinitio Studies of Structural Features Not Easily Amenable to Experiment .2. The Influence of Bond Delocalization Effects on the Molecular-Structures of Some Lithium-Fluoride ClustersJournal of Chemical PhysicsJournal Article1981
Abinitio Studies of Structural Features Not Easily Amenable to Experiment - the Molecular-Structures of 2 Low-Energy Forms of Unionized SerineChemical Physics LettersJournal Article1981
Abinitio Studies of Structural Features Not Easily Amenable to Experiment - the Molecular-Structures of Some Hydrogen-Fluoride ClustersChemical Physics LettersJournal Article1980
Structure Determination of 1-Butene by Gas Electron-Diffraction, Microwave Spectroscopy, Molecular Mechanics, and Molecular-Orbital Constrained Electron-DiffractionJournal of the American Chemical SocietyJournal Article1980
Theory Versus Experiment - the Case of GlycineJournal of the American Chemical SocietyJournal Article1980
Molecular-Orbital Constrained Electron-Diffraction Studies - Conformational Behavior of 1,2-DimethylhydrazineJournal of the American Chemical SocietyJournal Article1979
Abinitio Equilibrium Structures of Unionized Amino-Acids - AlanineChemical Physics LettersJournal Article1979
Normal Coordinate Abinitio Calculations of Cubic Anharmonicity ConstantsChemical Physics LettersJournal Article1979
Practical Method for Calculating Approximate Mean Amplitudes of Vibration without Refined Force-FieldsJournal of Molecular StructureJournal Article1979
Abinitio Equilibrium Geometry and Conformational-Analysis of Acetamide.Journal of Molecular StructureJournal Article1979
Comment and Evaluation Concerning Some Partial-Wave Electron-Scattering Factors Frequently Used in Gas Electron-DiffractionJournal of Molecular StructureJournal Article1978
Normal Coordinate Abinitio Force RelaxationChemical Physics LettersJournal Article1978
Investigations Concerning Apparent Contradiction between Microwave Structure and Abinitio Calculations of GlycineJournal of the American Chemical SocietyJournal Article1978
Vibrational Analyses Employing Cartesian CoordinatesJournal of Molecular StructureJournal Article1977
Dipole-Moment, Polarizability, and Energy Surfaces for (H2)2Abstracts of Papers of the American Chemical SocietyAbstract1977