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CNDO/2: 作品数：66被引量：88H指数：5; 导出分析报告; 相关领域：理学更多>>; 相关作者：陈志行许旋罗一帆苏忠民李卫华更多>>; 相关机构：中国科学院中山大学华南师范大学辽宁大学更多>>; 相关期刊：《Wuhan University Journal of Natural Sciences》《计算机与应用化学》《物理化学学报》《华南师范大学学报（自然科学版）》更多>>; 相关基金：国家自然科学基金广东轻院科研启动基金广东省自然科学基金江苏省科委自然科学基金更多>>

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期刊=Science Bulletin

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Study of Coenzyme B_(12) Model Compounds——CNDO/2 Calculation of C_2H_5Co (SB) and RCo (salen) L Complexes: 《Chinese Science Bulletin》1994年第12期1007-1010,共4页韩德艳陈慧兰缪强俞马宏倪浩唐雯霞; Project supported by the National Natural Science Foundation of China.; To synthesize and study the relation between structure and characteristics of Co-Cbond of coenzym B₁₂ model compounds, it is an effective way to understand the fac-tors which can influence the stabilities o...; 关键词：COENZYME B12 model compound Co - C BOND BOND order CNDO/2.

A CNDO/2 STUDY ON CIS^- AND TRANS^- [Pt(NH_3)_2CI_2] AND THEIR AQUO- TRANSITION STATES: 《Chinese Science Bulletin》1983年第11期1496-1501,共6页朱龙根曲筠唐雯霞; Ⅰ. INTRODUCTION Since it was discovered that cis-platin inhibited the cell division of E. coli and possessed antitumour activity, much study has been made on the relationship between the structure and the antitumour ...; 关键词：ISOMERS COMPLEXES PLATINUM possessed showing inhibited SUBSTITUTION figuration TRANS FRONTIER

CNDO/2 CALCULATIONS OF PROTONATED COMPLEXES OF ISOBUTENE AND FORMALDEHYDE OVER SOLID ACIDIC CATALYST: 《Chinese Science Bulletin》1980年第7期566-572,共7页汪汉卿陈治文陈英武; There have been much interest in and many applications of the approximate molecular orbital (MO) methods in the study of catalysis in recent years, with the study of the various aspects of chemisorption on metallic at...; 关键词：metallic OVER SOLID approximate elucidate catalysis orbital BECOMING adsorbed Configuration

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