An adjustable contracted CI method
文献类型:期刊论文
作者 | Wang, YB; Gan, ZT; Su, KH; Wen, ZY |
刊名 | SCIENCE IN CHINA SERIES B-CHEMISTRY
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出版日期 | 1999-12-01 |
卷号 | 42页码:649-655 |
关键词 | configuration interaction contracted CI method correlation energy |
ISSN号 | 1006-9291 |
英文摘要 | A new contracted CI scheme-adjustable contracted CI scheme-is presented and programed. The efficiency of this scheme is tested by some example calculations. The result shows that the application of the new scheme is flexible and the correlation energy loss is lower than that of the original externally contracted CI method. |
WOS关键词 | CONFIGURATION-INTERACTION ; METHYLENE |
WOS研究方向 | Chemistry |
语种 | 英语 |
WOS记录号 | WOS:000084653800013 |
出版者 | SCIENCE PRESS |
源URL | [http://119.78.100.186/handle/113462/35874] ![]() |
专题 | 中国科学院近代物理研究所 |
通讯作者 | Wen, ZY |
作者单位 | NW Univ Xian, Inst Modern Phys, Xian 710069, Peoples R China |
推荐引用方式 GB/T 7714 | Wang, YB,Gan, ZT,Su, KH,et al. An adjustable contracted CI method[J]. SCIENCE IN CHINA SERIES B-CHEMISTRY,1999,42:649-655. |
APA | Wang, YB,Gan, ZT,Su, KH,&Wen, ZY.(1999).An adjustable contracted CI method.SCIENCE IN CHINA SERIES B-CHEMISTRY,42,649-655. |
MLA | Wang, YB,et al."An adjustable contracted CI method".SCIENCE IN CHINA SERIES B-CHEMISTRY 42(1999):649-655. |
入库方式: OAI收割
来源:近代物理研究所
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