• Scope of the course? (课程涵盖范围) • Applications (应用) • Prerequisites (先修知识要求) • Solution procedure (课程内容概览) • What did we learn from mechanics of material (材力概念回顾) • Generalization of concepts (材力概念扩展) • A 1D example of boundary value problems (1D边值问题示例) • Course outline (课程主要内容) • References (参考书目) • Grading and collaboration policies (评分政策) • Greek letters (希腊字母)
Application of MR2T2 algorithm in statistical mechanics Canonical ensemble: Distribution function: p(rN)=exp(-E(rN)/KT)/Q Q= JdrN exp(-E(rN)/kT) Different states of the Markov chain: In the application of Metropolis algorithm to a simulation of molecular system, the states of the Markov chain correspond to different configurations of the molecular system