The nobel prize in chemistry : robert s . mulliken 诺贝尔化学奖-罗伯持桑德逊马利肯
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1966 robert s . mulliken 1967 manfred eigen germany 1967年曼弗雷德艾根德国
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For experimental measurement . the spin density distributions are in detail discussed on the basis of mulliken population analysis , taking into account the coexistence of spin delocalization and spin polarization mechanisms . for 密度泛函自旋密度自旋极化自旋离域分子磁性中图分类号：
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In order to give its movement a quantitive description , we carry out the computation of it by using gaussian03 . and we developed a special method to clear the error during computation of biomolecular . then we compute the kinesin ' s head and microtubule and got the mulliken charge distribution 为了对马达在运动过程中的特性进行定量的分析，我们发展了一种特殊的方法来解决利用gaussian03对大分子进行计算时遇到的断口问题，并对kinesin的头部和微管进行了计算，得到了mulliken电荷分布等信息。
