Publications from the Department of Chemistry faculty at the University of Rhode Island.

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Submissions from 1989

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Classical monte carlo dynamics: A simulated annealing approach to the construction of double‐ended classical trajectories, J. D. Doll, Thomas L. Beck, and David L. Freeman

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Effect of Increasing Propyl Group Substitution on PermethyI Polyazine, William B. Euler and Gregory S. King

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Solid state NMR on oligomeric and polymeric azines, William B. Euler and James E. Roberts

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Solid-State13C NMR Study of Oligomeric and Polymeric Azines, William B. Euler and James E. Roberts

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Kinetics of the reduction of the tetrahydroxyargentate(III) ion by sulphite in aqueous alkaline media, Louis J. Kirschenbaum, Issifou Kouadio, and Edoardo Mentasti

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vic-Dioximate Complexes of Silver(III), Louis J. Kirschenbaum, Rama K. Panda, Edward T. Borish, and Edoardo Mentasti

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Kinetics and Mechanism of the Oxidation of the Hypophosphite Ion by the Tetrahydroxoargentate(III) Ion, Raj N. Mehrotra and Louis J. Kirschenbaum

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Binding energy of large icosahedral and cuboctahedral Lennard-Jones clusters, J. A. Northby, J. Xie, David Freeman, and J. D. Doll

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Kinetics and mechanism of the reaction between 4-t-butylphenolate anion and tetrahydroxoargentate(III) in aqueous alkaline media, Rama K. Panda and Louis J. Kirschenbaum

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Theoretical Studies of the Energetics and Structures of Atomic Clusters, J. Xie, J. A. Northby, David L. Freeman, and Jimmie D. Doll

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Monte Carlo Studies of Hydrogen Flouride Clusters: Cluster Size Distributions in Hydrogen Flouride Vapor, Changyin Zhang, David L. Freeman, and Jimmie D. Doll

Submissions from 1988

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Steric and Electronic Interactions between Cofacial Metallocene Rings, Regina Arnold, Bruce M. Foxman, Myron Rosenblum, and William B. Euler

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Stationary phase Monte Carlo methods: An exact formulation, J. D. Doll, D. L. Freeman, and M. J. Gillan

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Quantum Monte Carlo Dynamics: the Stationary Phase Monte Carlo Path Integral Calculation of Finite Temperature Time Correlation Functions, Jimmie D. Doll, Thomas L. Beck, and David L. Freeman

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A Comparative Analysis of Stationary-Phase Monte Carlo Methods, Jimmie D. Doll and David L. Freeman

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Infrared spectra of iodine doped polyazines, William B. Euler

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Kinetics and mechanism of the reaction between silver(III) and thiourea in aqueous alkaline media, Louis J. Kirschenbaum and Rama K. Panda

Submissions from 1987

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Toward a Monte Carlo Theory of Quantum Dynamics, Jimmie D. Doll, R. D. Coalson, and David L. Freeman

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Extended Hückel calculations on defect states in the π system of polyazine, William B. Euler

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Structure of 2,3-Butanedione Dihydrazone and IR Study of Higher Polyazines: A New Class of Polymeric Conductors, Charles R. Hauer, Gregory S. King, Erica L. McCool, William B. Euler, and Joseph D. Ferrara

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Kinetics and mechanisms of the oxidation of Ni(II) and Cu(II) macrocycles by aquasilver(II) in acidic perchlorate media, Edoardo Mentasti and Louis J. Kirschenbaum

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Oxidation of organic compounds by silver(II). Reactions with aliphatic diols and α-hydroxy acids, Edoardo Mentasti and Louis J. Kirschenbaum

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Design of an automatic titrator, D. Migneault and R. K. Forcé

Submissions from 1986

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Partial Averaging Approach to Fourier Coefficient Path Integration, Rob D. Coalson, David L. Freeman, and Jimmie D. Doll

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Randomly exact methods, J. D. Doll and D. L. Freeman

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Exact Results for EPR g and A Tensors in the S1, = 1, 3/22, 5/2 and S2 = 1/2 Spin-Coupled Systems. The Effect When S Is Not a Good Quantum Number, William B. Euler

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Extended Huckel calculations on the Pi system of polyaniline, William B. Euler

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Fourier path integral methods: A model study of simple fluids, D. L. Freeman, R. D. Coalson, and J. D. Doll

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Interfacing a Cary 210 spectrophotometer to a Commodore PET 2001 microcomputer, D. Migneault, R. Mattera, and R. K. Forcé

Submissions from 1985

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The kinetics and stoicheiometry of silver(III) reduction by the octacyano-complexes of molybdenum(IV) and tungsten(IV), Edward T. Borish, Louis J. Kirschenbaum, and Edoardo Mentasti

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Fourier path-integral Monte Carlo methods: Partial averaging, J. D. Doll, Robert D. Coalson, and David L. Freeman

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A Comparison of Energy Estimators Used in Quantum Monte Carlo Calculations, Jimmie D. Doll and David L. Freeman

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Quantum Monte Carlo Study of the Thermodynamic Properties of Argon Clusters: the Homogenous nucleation of Argon in Argon Vapor and "Magic Number" Distributions in Argon Vapor, David L. Freeman and Jimmie D. Doll

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Reactions of Trivalent Silver with One‐Electron Reducing Agents, Louis J. Kirschenbaum, Edward T. Borish, and James D. Rush

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Kinetics and mechanisms of complex formation of gallium(III) and indium(III). The reactions with 4-(2-pyridylazo)resorcinol in water and other mixed solvents, Edoardo Mentasti, Claudio Baiocchi, and Louis J. Kirschenbaum

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Complexes of silver(III) with oxoanions, James D. Rush and Louis J. Kirschenbaum

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Reaction of the Tetrahydroxoargentate(III) Ion with Thiosulfate, James D. Rush and Louis J. Kirschenbaum

Submissions from 1984

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Kinetics and Mechanism of Silver(III) Reduction by Azide Ion in Aqueous Alkaline Media, Edward T. Borish and Louis J. Kirschenbaum

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Double Integration and Titration of the Electron Paramagnetic Resonance Signal in the Molybdenum Iron Protein of Azotobacter vinelandii, W. B. Euler, J. Martinsen, J. W. McDonald, G. D. Watt, Z. C. Wang, and Brett L. Lucht

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Madelung Energy Calculations on the Highly Conducting Molecular Metal Nickel Phthalocyanine Iodide, William B. Euler

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Extended Huckel calculations on azo and azine analogues of polyacetylene, William B. Euler and Charles R. Hauer

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A Monte Carlo Method for Quantum Boltzmann Statistical Mechanics Using Fourier Representations of Path Integrals, David L. Freeman and Jimmie D. Doll

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Polypeptide Complexes of Silver(III), Louis J. Kirschenbaum and James D. Rush

Submissions from 1983

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Kinetics and mechanism of hydrogen peroxide oxidation by silver(III) in aqueous alkaline media, Edward T. Borish and Louis J. Kirschenbaum

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Langevin Analysis of the Diffusion Model for Surface Chemical Reactions, David L. Freeman and Jimmie D. Doll

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The Influence of Diffusion on Surface Reaction Kinetics, David L. Freeman and Jimmie D. Doll

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Coupled-cluster summation of the particle-particle ladder diagrams for the two-dimensional electron gas, D. L. Freeman

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Diaxial complexation in a sterically hindered nickel(III) tetraaza macrocycle: An ESR study, Louis J. Kirschenbaum and Robert I. Haines

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Kinetics of the Reduction of the Tetrahydroxoargentate(III) Ion by Arsenite, Louis J. Kirschenbaum and James D. Rush

Submissions from 1982

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Stabilization of the Tervalent Nickel Complex with meso-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane by Axial Coordination of Anions in Aqueous Solution, Esther Zeigerson, Ilana Bar, Joel Bernstein, Louis J. Kirschenbaum, and Dan Meyerstein

Submissions from 1981

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A pulse radiolysis study of the MnO2-4 ion. The stability of Mn(V) in 0.1 M NaOH, Louis J. Kirschenbaum and Dan Meyerstein

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Difference in the Stabilities of the Diastereoisomers of the Tervalent Nickel Complex with 5,7,7,12,14,14-Hexamethyl-1,4,8,11 -tetraazacyclotetradecane in Sulfate- and Perchlorate-Containing Aqueous Solutions. An Electrochemical and Pulse Radiolysis Study, Esther Zeigerson, Gregory Ginzburg, James Y. Becker, Louis J. Kirschenbaum, Haim Cohen, and Dan Meyerstein

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The electrochemical oxidation of divalent nickel complexes with tetra-aza-macrocyclic ligands in aqueous solutions, Esther Zeigerson, Gregory Ginzburg, Louis J. Kirschenbaum, and Dan Meyerstein

Submissions from 1980

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Comparative study of the electrochemical and pulse-radiolytic oxidation of the complexes of nickel(II) and copper(II) containing 1,4,8,11-tetra-azacyclotetradecane, Esther Zeigerson, Gregory Ginzburg, Dan Meyerstein, and Louis J. Kirschenbaum

Submissions from 1979

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Complexation of a Nickel(III) Macrocyclic Complex by Sulfate Ion. A Pulse Radiolytic Study, Haim Cohen, Dan Meyerstein, Dan Meyerstein, Louis J. Kirschenbaum, Esther Zeigerson, Moshe Jaacobi, Efrat Fuchs, Gregory Ginzburg, and Louis J. Kirschenbaum

Submissions from 1978

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A numerical solution to the integral equation for atomic pair energies, N. C. Dutta and David L. Freeman

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Application of the coupled-cluster expansion to the correlation energy of electrons in two-dimensional and quasi-two-dimensional systems, D. L. Freeman

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Kinetics of Silver(III) Decomposition in Dilute Acid, Louis J. Kirschenbaum and Linda Mrozowski

Submissions from 1976

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Many-Body Perturbation Theory Applied to Molecules: Analysis and Correlation Energy Calculation for Li2, N2, and H3, David L. Freeman and Martin Karplus

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A kinetic study of the reduction of the tetrahydroxoargentate(III) ion by ethylenediamine, Louis J. Kirschenbaum

Submissions from 1975

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The Interaction of Rare Gas Atoms with Graphite Surfaces. II. Adatom–adatom Potentials, David L. Freeman

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The Interaction of Rare Gas Atoms with Graphite Surfaces. I. Single Adatom Energies, David L. Freeman

Submissions from 1971

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Crystal to Liquid-Crystal Transition Studied by Raman Scattering, W. J. Borer, S. S. Mitra, and C. W. Brown