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"Density Functional Theory of Open-Shell Systems. The 3d-Series Transition Metal Atoms and Their Cations," S. Luo, B. Averkiev, K. R. Yang, X. Xu, and D. G. Truhlar, Journal of Chemical Theory and Computation 101, 102-121 (2014). ÕâÆªÎÄÕÂÓÐÌáµ½£¬¹À¼Æ»á¶ÔÄãµÄÌáÐÑÓаïÖú http://hi.baidu.com/coolrainbow/item/5b3b8d7b1ddbd120d7a89c91 ÕâÆªÌû×ÓÒ²ÓкܺõĽéÉÜ |
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