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21 ta ish

Ish: A study of H2CO•••HF Complex by Advanced Quantum Mechanical Methods

  1. The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

    Samuel Francis Boys, Fernando Bernardi

    Maqola197030 iqtibos
    ABI

  2. Hydrogen Bonding

    Steve Scheiner

    Kitob19977 iqtibos
    ABI

  3. Quantum-chemical modeling of energy parameters and vibrational spectra of chain and cyclic clusters of monohydric alcohols

    Pavlo Golub, I. Doroshenko, V. Pogorelov

    Maqola20146 iqtibos
    ABI

  4. Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update

    E. P. HUNTER, Sharon G. Lias

    Maqola19986 iqtibos
    ABI

  5. Comparison of Degrees of Potential-Energy-Surface Anharmonicity for Complexes and Clusters with Hydrogen Bonds

    Е.N. Kozlovskaya, I. Doroshenko, V. Pogorelov +2

    MaqolaOchiq kirish20185 iqtibos
    ABI

  6. Evaluated Gas Phase Basicities and Proton Affinities of Molecules; Heats of Formation of Protonated Molecules

    Sharon G. Lias, Joel F. Liebman, R. Levin

    Maqola19844 iqtibos
    ABI

  7. Determination of mechanisms of the ν1(H–F) band shape formation in the absorption spectra of H-bonded complexes of HF from combined experimental studies and nonempirical calculations

    V. P. Bulychev, К. Г. Тохадзе

    Maqola20142 iqtibos
    ABI

  8. Anti-Hydrogen Bond in the Benzene Dimer and Other Carbon Proton Donor Complexes

    Pavel Hobza, V. Špirko, H. L. Selzle +1

    Maqola19982 iqtibos
    ABI

  9. The structure and vibrational spectral parameters of a complex of HF with the planar (H2CO)2 dimer

    V. P. Bulychev, Aleksei Koshevarnikov, К. Г. Тохадзе

    Maqola20172 iqtibos
    ABI

  10. Sarlavhasiz

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