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Atomistic density functional theory and its application to hydration free-energy calculations
【机 构】
：
StateKeylaboratoryofChemicalengineering,EastChinaUniversityofScienceandTechnology,Shanghai200237Depa
【出 处】
：
中国化学会第十六届全国化学热力学和热分析学术会议
【发表日期】
：
2012年10期
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