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Work: Evaluation of the growth process of soot mass due to changes in hydrogen atomic percentage and external heat flux using molecular dynamics simulation

  1. The missing term in effective pair potentials

    Herman J. C. Berendsen, J. Raúl Grigera, Tjerk P. Straatsma

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  2. The Art of Molecular Dynamics Simulation

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  4. DREIDING: a generic force field for molecular simulations

    Stephen L. Mayo, Barry D. Olafson, William A. Goddard

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  5. Understanding Molecular Simulation: From Algorithms to Applications

    Daan Frenkel, Berend Smit

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