no code implementations • 21 Jan 2021 • Xiaoqing Liu, XiaoJing Wang, Tianhao Yu, Weizhen Zhao, Lei Liu
Spatial distribution function (SDF) results show that toluene formed a continuum solvation shell, which hinders the interactions of (tBu)3P and B(C6F5)3 , while [Cnmim][NTf2] leave a relatively large empty space, which is accessible by (tBu3)P molecules, resulting in a higher probability of Lewis acids and bases interactions.
Chemical Physics
