Systems for simulating the chemical and physical properties of soot precursors in a combustion environment are disclosed. The systems provide information on the physical and chemical structure of the nanoparticles formed in a combustion environment as part of the transition from gas-phase precursors to soot particles. The systems combine Kinetic Monte Carlo and Molecular Dynamics to model soot inception.
申请公布号
WO2006081581(A3)
申请公布日期
2006.10.05
申请号
WO2006US03559
申请日期
2006.01.27
申请人
UNIVERSITY OF UTAH RESEARCH FOUNDATION;VOTH, GREGORY, A.;VIOLI, ANGELA