Richard A. Friesner
Department of Chemistry
3000 Broadway, mail code 3110
New York , NY 10027

work : +1 212-854-7606
fax : +1 212-854-7454
rich@chem.columbia.edu


Friesner Group

1985 - 1989 Publications


32.                 Lagos, R,E., R.A. Friesner, Optical-Spectrum of Crystalline Anthracene - Comparison between Theory and Experiment, Chem. Phys. Lett., 122 (1-2): 98-102 (1985).

33.                 Friesner, R.A., Solution of Self-Consistent Field Electronic-Structure Equations by a Pseudospectral Method, Chem. Phys. Lett., 116 (1): 39-43 (1985).

34.                 Friesner, R.A., R.E. Wyatt, Quantum Statistical-Mechanics via the Recursive Residue Generation Method, J. Chem. Phys., 82 (4): 1973-1982 (1985).

35.                 Friesner, R., M. Pettitt, J.M. Jean, Calculation of Temperature-Dependent Multimode Resonance Raman Line-Shapes for Harmonic Potential Surfaces, J. Chem. Phys., 82 (7): 2918-2926 (1985).

36.                 Won, Y., R. Lagos, R.Friesner, Numerical Tests of a Generalized Multilevel Vibronic Coupling Formalism, J. Chem. Phys., 84 (12): 6567-6574 (1986).

37.                 Moiseyev, N., R.A. Friesner, R.E. Wyatt, Natural Expansion of Vibrational Wave-Functions - Rrgm with Residue Algebra, J. Chem. Phys., 85 (1): 331-336 (1986).

38.                 Jean, J.M., R.A. Friesner, An Accurate and Efficient Decoupling Approximation for Temperature-Dependent Multimode Resonance Raman-Spectra, J. Chem. Phys., 85 (5): 2353-2364 (1986).

39.                 Friesner, R.A., Solution of the Hartree-Fock Equations by a Pseudospectral Method - Application to Diatomic-Molecules, J. Chem. Phys., 85, 3, 1462-1468 (1986).

40.                 Friesner, R.A., R.E. Wyatt, C. Hempel, et. al., A Generalized Version of the Recursive Residue Generation Method for Vector Computers, J. Com. Chem. Phys., 64 (1): 220-229 (1986).

41.                 Won, Y.D., R.A. Friesner, Simulation of Photochemical Hole-Burning Experiments on Photosynthetic Reaction Centers, Proc. Nat. Acad. Sci., 84 (16): 5511-5515 (1987).

42.                 Lagos, R.E., R.A. Friesner, Green-Functions for Anisotropic Tight-Binding Hamiltonians - Application to Exciton Migration and Optical Lineshape, J. Physics C-Solid State Physics 20 (29): 4833-4843 (1987).

43.                 Friesner, R.A., Solution of the Hartree-Fock Equations for Polyatomic-Molecules by a Pseudospectral Method, J. Chem. Phys., 86 (6): 3522-3531 (1987).

44.                 Friesner, R.A., J.P. Brunet, R.E. Wyatt, et. al., Computational Approach to Large Quantum Dynamic Problems, Inter. J. Supercomputer Applications and High Performance Computing, 1 (1): 9-23 (1987).

45.                 Friedrichs, M.S., R.A. Friesner, Solution of the Pauli Master Equation Via the Lanczos-Algorithm, Chem. Phys. Lett., 137 (3): 285-290 (1987).

46.                 Zhang, P., R.M. Levy, R.A. Friesner, Variable Quadratic Propagator for Quantum Monte-Carlo Simulations, Chem. Phys. Lett., 144 (3): 236-242 (1988).

47.                 Won, Y.D., R.A. Friesner, On the Viability of the Superexchange Mechanism in the Primary Charge Separation Step of Bacterial Photosynthesis, Biochimica Et Biophysica Acta 935 (1): 9-18 (1988). 

48.                 Won, Y.D., R.A. Friesner, A Thermal-Expansion Model for the Special Pair of the Bacterial Reaction Center, Israel J. Chem., 28 (2-3): 67-72 (1988).

49.                 Brunet, J.P., R.A. Friesner, R.E. Wyatt, et. al., Theoretical-Study of the IR Absorption-Spectrum of Hcn, Chem. Phys. Lett., 153 (5): 425-432 (1988).

50.                 Won, Y., and R.A. Friesner, Theoretical-Studies of Photochemical Hole Burning in Photosynthetic Bacterial Reaction Centers, J. Phys. Chem., 92 (8): 2214-2219 (1988).

51.                 Won, Y., and R.A. Friesner, Simulation of Optical-Spectra from the Reaction Center of Rhodopseudomonas-Viridis, J. Phys. Chem., 92 (8): 2208-2214 (1988). 

52.                 Schnitker, J., K. Motakabbir, P.J. Rossky, R.A. Friesner, et. al., A-Priori Calculation of the Optical-Absorption Spectrum of the Hydrated Electron, Phys. Rev. Lett., 60 (5): 456-459 (1988).

53.                 Friesner, R.A., An Automatic Grid Generation Scheme for Pseudospectral Self-Consistent Field Calculations on Polyatomic-Molecules, J. Phys. Chem., 92 (11): 3091-3096 (1988).

54.                 Friedrichs, Mark, S. Richard A. Friesner and Allen J. Bard, A new approach to electrochemical simulations based on eigenvector-eigenvalue solutions of the diffusion equations: Part I. Potentiostatic boundary conditions, J. Electroanalytical Chemistry, 258, 2, 243-264 1989).

55.        Bentley, J.A., J. P. Brunet, R. E. Wyatt, C. Leforestier, and R. Friesner, Quantum Mechanical Study of the SEP Spectrum for HCN, Chem. Phys. Lett.  161, 393 (1989).

56.                 Friesner, R. and Y. Won, Spectroscopy and Electron Transfer Dynamics of the Photosynthetic Reaction Center, Biochim. Biophy. Acta. 977, 99 (1989).

56.                 Won, Y.,  R. Friesner, J. Sessler, and M. Johnson, Exciton Interactions in Model Porphyrin Dimers, Photosynthesis Research 22, 201 (1989).

57.                 Friesner, R. and Y. Won, Photochemical Charge Separation in Photosynthetic Reaction Centers, Photochem. Photobiol. 50, 831 (1989).