Search Results - Hariharan, P.C.

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  1. 1
    The effect of d-functions on molecular orbital energies for hydrocarbons

    The effect of d-functions on molecular orbital energies for hydrocarbons by Hariharan, P.C., Pople, J.A.

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  2. 2
    Ab initio MRD CI ground and excited state potential curves for addition of O to H 2CCH 2 and oxirane formation and decomposition

    Ab initio MRD CI ground and excited state potential curves for addition of O to H 2CCH 2 and oxirane formation and decomposition by Roszak, S., Buenker, R.J., Hariharan, P.C., Kaufman, Joyce J.

    Published in Chemical physics
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  3. 3
    Potential energy curve of 1Σ + Li +/He

    Potential energy curve of 1Σ + Li +/He by Hariharan, P.C., Staemmler, V.

    Published in Chemical physics
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  4. 4
    Ab initio MRD CI ground and excited state potential curves for addition of O to H2C=CH2 and oxirane formation and decomposition

    Ab initio MRD CI ground and excited state potential curves for addition of O to H2C=CH2 and oxirane formation and decomposition by ROSZAK, S, BUENKER, R. J, HARIHARAN, P. C, KAUFMAN, J. J

    Published in Chemical physics
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  5. 5
    POLY-CRYST — A program for ab-initio crystal orbitals and polymer orbitals

    POLY-CRYST — A program for ab-initio crystal orbitals and polymer orbitals by Blaisdell, John J., Sokalski, W.A., Hariharan, P.C., Kaufman, Joyce J.

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  6. 6
    Energy transfer in Br +-Kr collisions

    Energy transfer in Br +-Kr collisions by Balasubramanian, K., Kaufman, Joyce J., Hariharan, P.C., Koski, Walter S.

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  7. 7
    Molecular orbital theory of simple carbonium ions

    Molecular orbital theory of simple carbonium ions by Hariharan, P.C., Lathan, W.A., Pople, J.A.

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  8. 8
    Architecture and design of storage and data management for the NASA Earth observing system Data and Information System (EOSDIS)

    Architecture and design of storage and data management for the NASA Earth observing system Data and Information System (EOSDIS) by Kobler, B., Berbert, J., Caulk, P., Hariharan, P.C.

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  9. 9
    A new computational strategy for ab-initio MRD-CI calculations for breaking a chemical bond in a molecule in a crystal or other solid environment

    A new computational strategy for ab-initio MRD-CI calculations for breaking a chemical bond in a molecule in a crystal or other solid environment by Kaufman, Joyce J., Roszak, Szczepan, Hariharan, P.C., Keegstra, Phillip B.

    Published in Computers & chemistry
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