多尺度晶体材料的原位表征技术与计算模拟研究进展

陈昆峰, 胡乾宇, 刘锋, 薛冬峰

Multi-scale Crystallization Materials: Advances in in-situ Characterization Techniques and Computational Simulations

CHEN Kunfeng, HU Qianyu, LIU Feng, XUE Dongfeng

图13 通过路径搜索方法研究C60二聚体结合的最佳路线[94]

Fig. 13 Structural snapshots and relationship between energy and GSW of the optimal route for C60 dimer binding by the path search method[94] (a-f) Structural snapshots and relationship between energy and GSW steps; (g) GSW in the 0, 5, 15, 25, 40, and 80 GSW steps. Red and green represent two carbon atoms in C60, respectively