【摘 要】
：
We have studied the ground and excited states of the three dendritic polynuclear Pt(Ⅱ) complexes 1-[Cl(PH3)2PtC≡C]-3,5-[HC≡C]C6H3 (1), 1,3-[Cl(PH3)2PtC≡C]2-
【机 构】
：
StateKeyLaboratoryofTheoreticalandComputationalChemistry,SchoolofChemistryandMaterialsScience
【基金项目】
：
Supported by the National Natural Science Foundation of China (Grant Nos. 20573042, 20333050 and 20173021), Natural Science Foundation of Heilongjiang Province of China (Grant No. B200601) and Science
论文部分内容阅读
We have studied the ground and excited states of the three dendritic polynuclear Pt(Ⅱ) complexes 1-[Cl(PH3)2PtC≡C]-3,5-[HC≡C]C6H3 (1), 1,3-[Cl(PH3)2PtC≡C]2-5-[HC≡C]C6H3 (2), and 1,3,5-[Cl(PH3)2- PtC≡C]3C6H3 (3), by using the B3LYP and UB3LYP methods, resp
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