122nd General Meeting of the KCS

Type Poster Presentation
Area Physical Chemistry
Room No. Grand Ballroom
Time 10월 19일 (금요일) 11:00~12:30
Code PHYS.P-196
Subject Difference between results of random walk simulations and diffusion-reaction theory in two and three dimensions
Authors Junmyeong Jeong, Taehyun Yun1, Taejun Kim*, Hyojoon Kim*
Department of Chemistry, Dong-A University, Korea
1Dong-A University, Korea
Abstract The random walk simulation usually predicts the theoretical results in the diffusion-influenced reaction field with accuracy in various dimensions. While one dimensional results of simulation and theoretical approaches are in agreement, significant differences are shown between simulation and theoretical results in two and three dimensions. We have quantified the difference rigorously. We study why the differences exist in higher dimensional results and suggest the optimum lattice constants.
E-mail jsh3659@naver.com