Ab Initio Study on The Influence of Spin State upon Bonding and Interaction in Fe-COBondCovalenciesinR2BaCuO5(R=Sm,Gd,Dy,Ho,Y,Er,Tm,Yb,Lu)

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作者
XU Xin**
机构
关键词
Ab initio; Carbon monoxide; Iron; Transitionmetal carbonyl; Bonding mechanism;
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中图分类号
O641.4 [络合物化学(配位化学)];
学科分类号
070304 ; 081704 ;
摘要
IntroductionTransitionmetal-carbonylsystemsM-COhavebeenthefocusofcontinuousstudiesboththeoreticalyandexperimentaly[1,2].Theim...
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页码:71 / 81
页数:11
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