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通过自由能计算预测表面活性剂分子在溶液与表面的平衡
【机 构】
：
上海交通大学化学化工学院, 上海,200240
【出 处】
：
第十二届全国计算(机)化学学术会议
【发表日期】
：
2013年11期
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