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Polymer yields from continuous model

Figure 5 is a plot of the calculated polymer yields from the continuous model C0NGAS vs. the yields from the semibatch model... [Pg.211]

Another method that introduces a very simplified dynamics is the Multi-Particle Collision Model (or Stochastic Rotation Model) [130]. Like DSMC particle positions and velocities are continuous variables and the system is divided into cells for the purpose of carrying out collisions. Rotation operators, chosen at random from a set of rotation operators, are assigned to each cell. The velocity of each particle in the cell, relative to the center of mass velocity of the cell, is rotated with the cell rotation operator. After rotation the center of mass velocity is added back to yield the post-collision velocity. The dynamics consists of free streaming and multi-particle collisions. This mesoscopic dynamics conserves mass, momentum and energy. The dynamics may be combined with full MD for embedded solutes [131] to study a variety of problems such as polymer, colloid and reaction dynamics. [Pg.436]


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Continuous model

Polymer (continued

Polymers yield

Yield modeling

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