| 聚合物PPV,PDMPV自掺杂导电性研究 |
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| 引用本文： | 艾军,黄宗浩.聚合物PPV,PDMPV自掺杂导电性研究[J].材料科学与工艺,1997,5(2):93-95. |
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| 作者姓名： | 艾军 黄宗浩 |
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| 作者单位： | [1]哈尔滨工业大学 [2]东北师范大学化学系 |
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| 摘 要： | 报道用带有晶体轨道的ＥＨＭＯ量子化学计算程序对ＰＰＶ及其取代物ＰＤＭＰＶ本征态、双极化子进行了理论计算，合理地解释了由于ＣＨ３Ｏ－自掺杂导致ＰＤＭＰＶ特殊电性能这一实验事实。同时利用电离势、分子电荷图对两种聚合物导电性能的差异性作了讨论。
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| 关 键 词： | 自掺杂 电离势 PPV PDMPV 聚合物 电导率 |
Study on Electric Conductivity of Polymer PPV and PDMPV |
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| Ai,Jun,Bai Yongping,Feng Liqun,Wei Yuezhen,Huang Zonghao,Wao Rongshun.Study on Electric Conductivity of Polymer PPV and PDMPV[J].Materials Science and Technology,1997,5(2):93-95. |
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| Authors: | Ai Jun Bai Yongping Feng Liqun Wei Yuezhen Huang Zonghao Wao Rongshun |
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| Affiliation: | Ai Jun Bai Yongping Feng Liqun Wei Yuezhen Huang Zonghao Wao Rongshun (Harbin lnstitute of Technology) (The Northeast Normal University) |
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| Abstract: | In this paper, the unique electric conductivity of poly (p-phenylene vinglene) and poly, (2,5-dimethoxy-phenylene vinglene) has been studied by EHMO quantum caculation method. The results can be used to properly interprete the difference in electric conductivity between PPV and PDMPV. |
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| Keywords: | Self-doping ehmo ionization energy map of molecular |
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