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Theoretical Study on the Molecular Orbital and Stabilization Energy of Substituted Lithium Carbene Cations
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作者 Ji Hai LI Sheng Yu FENG Jian Jun GAO(College of Chemisny, Shandong University, Jinan 250100) 《Chinese Chemical Letters》 SCIE CAS CSCD 1998年第4期411-414,共4页
The stabilization energies of substituted lithium carbene cations were calculated by using ab initio molecular orbital theory, and the relationship between the stabilization energies and molecular orbitals was discuss... The stabilization energies of substituted lithium carbene cations were calculated by using ab initio molecular orbital theory, and the relationship between the stabilization energies and molecular orbitals was discussed. The substituents with pi donor engender strong stabilization to CH2Li+. The calculations show the Y-C* bond lengths of cations become shorter and H-Y bond lengths longer than those of corresponding neutral molecules. 展开更多
关键词 ab initio molecular orbital stabilization energy lithium carbene cation engender
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A Mathematical Model for the Deficiency-Excess Mechanism of Yin-Yang in Five Viscera
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作者 Jinhyun Kim Miyoung Song +4 位作者 Jungim Kang Sang-Kyun Kim Changseok Kim Hyunchul Jang Sang-Hee Lee 《Chinese Journal of Integrative Medicine》 SCIE CAS 2014年第2期155-160,共6页
To raise traditional medicine to a higher level of scientific research, a mathematical model has been proposed using symbolic notations and operators to describe several disease symptoms generally recognized in tradit... To raise traditional medicine to a higher level of scientific research, a mathematical model has been proposed using symbolic notations and operators to describe several disease symptoms generally recognized in traditional medicine. Even though this model to a certain degree offers a mathematical approach to identify the relationships between yin-yang and the five viscera, it is not an efficient means of explaining the pathology in traditional medicine due to its use of superfluous notations and definitions. In this paper, we introduce two concise operators, a self-development operator and an action operator: the former describes the effect of a viscus in the unbalanced state on other viscera: the latter explains the engendering and restraining relationships between the two viscera. These tools are useful to elucidate the interactions among the states of the five viscera based on yin-yang and the five elements theory. Our mathematical model with these two operators facilitates description for the scheme of deficiency-excess of yin-yang in the five viscera. Accordingly, we have mathematically refined the existing results and shown clinical applications as well. 展开更多
关键词 deficiency-excess mechanism yin-yang theory engendering and the restraining operators
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