Search Results - Nemukhin, Alexandr V.

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  1. 1
    Performance of the Spin-Flip and Multireference Methods for Bond Breaking in Hydrocarbons:  A Benchmark Study

    Performance of the Spin-Flip and Multireference Methods for Bond Breaking in Hydrocarbons:  A Benchmark Study by Golubeva, Anna A, Nemukhin, Alexandr V, Klippenstein, Stephen J, Harding, Lawrence B, Krylov, Anna I

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  2. 2
    IR Matrix Isolation and ab Initio Identification of Products of the Reactions of CH3Cl and CH3Br with Mg

    IR Matrix Isolation and ab Initio Identification of Products of the Reactions of CH3Cl and CH3Br with Mg by Solov'ev, Viktor N, Sergeev, Gleb B, Nemukhin, Alexandr V, Burt, Stanley K, Topol, Igor A

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  3. 3
    Structure of Magnesium Cluster Grignard Reagents

    Structure of Magnesium Cluster Grignard Reagents by Nemukhin, Alexandr V, Topol, Igor A, Weinhold, Frank

    Published in Inorganic chemistry
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  4. 4
    IR Matrix Isolation and ab Initio Identification of Products of the Reactions of CH 3 Cl and CH 3 Br with Mg

    IR Matrix Isolation and ab Initio Identification of Products of the Reactions of CH 3 Cl and CH 3 Br with Mg by Solov'ev, Viktor N., Sergeev, Gleb B., Nemukhin, Alexandr V., Burt, Stanley K., Topol, Igor A.

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  5. 5
    Potential curves of BO and LiO calculated with the complete active space SCF (CASSCF) method

    Potential curves of BO and LiO calculated with the complete active space SCF (CASSCF) method by V. Nemukhin, Alexandr, Almlöf, Jan, Heiberg, Anders

    Published in Chemical physics
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