Search Results - Kattirtzi, J. A.

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    The effect of sampling techniques used in the multiconfigurational Ehrenfest method

    The effect of sampling techniques used in the multiconfigurational Ehrenfest method by Symonds, C., Kattirtzi, J. A., Shalashilin, D. V.

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    Shielding Constants and Chemical Shifts in DFT: Influence of Optimized Effective Potential and Coulomb-Attenuation

    Shielding Constants and Chemical Shifts in DFT: Influence of Optimized Effective Potential and Coulomb-Attenuation by Peach, Michael J. G, Kattirtzi, John A, Teale, Andrew M, Tozer, David J

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