'Bond stretching' diaporamas de présentation

Massively Distributed Computing and An NRPGM Project on Protein Structure and Function

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CHBE 452 Lecture 15

CHBE 452 Lecture 15. Theory Of Activation Barriers. Last Time Found Barriers To Reaction Are Caused By. Uphill reactions Bond stretching and distortion Orbital distortion due to Pauli repulsions Quantum effects Special reactivity of excited states. Today Models. Polanyi

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Molecular Mechanics (Molecular Force Fields)

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Molecular Dynamics Simulation of Sputtering and Pathway for Use in Thruster and Plume Analyses

Iain D. Boyd and Brandon Smith Department of Aerospace Engineering University of Michigan Ann Arbor, MI 48109. Molecular Dynamics Simulation of Sputtering and Pathway for Use in Thruster and Plume Analyses. Background (1). Electric propulsion (EP):

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Molecular dynamics (MD) simulations

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