Mathematical Problems in Engineering / 2009 / Article / Fig 2

Review Article

Simulation Algorithm That Conserves Energy and Momentum for Molecular Dynamics of Systems Driven by Switching Potentials

Figure 2

Temperature profile across the cell for different set conditions for temperature and step time pairs where . The curves results with the application of the algorithm at and with associated conditions while the curves are for the cases without implementing the algorithm with the associated conditions , , , , , where .

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