Search results for "Parallel algorithms"

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IDEA: interface dynamics and energetics algorithm.

2007

IDEA, interface dynamics and energetics algorithm, was implemented, in FORTRAN, under different operating systems to mimic dynamics and energetics of elementary events involved in interfacial processes. The code included a parallel elaboration scheme in which both the stochastic and the deterministic components, involved in the developed physical model, worked simultaneously. IDEA also embodied an optionally running VISUAL subroutine, showing the dynamic energy changes caused by the surface events, e.g., occurring at the gas-solid interface. Monte Carlo and ordinary differential equation system subroutines were employed in a synergistic way to drive the occurrence of the elementary events a…

Parallel algorithmsInterface (Java)FortranComputer scienceSubroutineMonte Carlo methodOdeMolecular modelingGeneral ChemistryIsothermal processMonte Carlo methodComputational MathematicsOrdinary differential equationStatistical physicscomputerAlgorithmOrdinary differential equationEnergy (signal processing)computer.programming_languageJournal of computational chemistry
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