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    Chapter and Conference Paper

    DFT-IET Method for Quantum-Classical Systems: Treatment of Solvated Quasiparticles

    The density functional theory of excess quantum particles in a classical polar liquid is presented. Starting from the grand partition function, we have developed a microscopic model and derived the free-energy...

    G.N. Chuev, M.V. Fedorov, N. Russo in Metal-Ligand Interactions (2003)