| Intra- and interpair electron correlation --Analysis of the G1 and G2 theories |
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| 作者姓名： | 居冠之 韦兆荣 |
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| 作者单位： | Department of Chemistry，Coordination Chemistry Institute，Nanjing University，Nanjing 210093，China，Department of Mathematics，Nanjing University，Nanjing 210093，China |
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| 基金项目： | Work supported by the National Natural Science Foundation of China |
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| 摘 要： | The irrationality of the HLC correction in the G1 and G2 theories has been analyzed concretely and deeply. Meanwhile, how to improve the Post-HF calculation has been pointed out.
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Intra- and interpair electron correlation --Analysis of the G1 and G2 theories |
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| JU Guanzhi.Intra- and interpair electron correlation --Analysis of the G1 and G2 theories[J].Science in China(Chemistry),1996(5). |
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| Authors: | JU Guanzhi |
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| Abstract: | The irrationality of the HLC correction in the G1 and G2 theories has been analyzed concretely and deeply. Meanwhile, how to improve the Post-HF calculation has been pointed out. |
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| Keywords: | interpair correlation intrapair correlation G1 and G2 theories HLC correction |
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