应用ABEEMσπ极化力场对Zn2+水溶液配位微结构和水交换反应进行分子动力学模拟研究
赫兰兰,郭宇,赵健,姜新蕊,杨忠志,赵东霞
Study on Coordination Microstructure andWater Exchange Reaction of Zn2+ Aqueous Solutions through Molecular Dynamics Simulations Using the ABEEMσπ Polarizable Force Field
Lan-Lan HE,Yu GUO,Jian ZHAO,Xin-Rui JIANG,Zhong-Zhi YANG,Dong-Xia ZHAO
物理化学学报 . 2016, (12): 2921 -2931 .  DOI: 10.3866/PKU.WHXB201609193