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首页> 外文期刊>Angewandte Chemie >Schrodinger Medal to C. Frenking
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Schrodinger Medal to C. Frenking

机译:薛定inger勋章(C. Frenking)

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摘要

Gemot Frenking (University of Marburg) was awarded the Schrodinger Medal by the World Association of Theoretical and Computational Chemists for his outstanding work in organometal-lic chemistry and the chemical bond. His group uses both quantum-chemical ab initio methods and density functional calculations together with effective potentials for heavy atoms. These methods are used to analyze the contributions of covalent and classical electrostatic interactions to the chemical bond throughout the periodic table and to explain metal-ligand interactions and reaction mechanisms. He recently discussed in Angewandte Chemie the possibility of synthesizing neutral noble-gas compounds with a bond between noble-gas atoms. In Chemistry-A European Journal, he investigated the interaction between steric and electronic effects in S_N2 reactions.
机译:Gemot Frenking(马尔堡大学)因其在有机金属化学和化学键方面的杰出工作而被世界理论和计算化学家协会授予Schrodinger奖章。他的小组使用量子化学从头算方法和密度泛函计算以及重原子的有效电势。这些方法用于分析整个元素周期表中共价键和经典静电相互作用对化学键的贡献,并解释金属-配体相互作用和反应机理。他最近在Angewandte Chemie中讨论了合成具有稀有气体原子之间键的中性稀有气体化合物的可能性。在《化学》(欧洲杂志)上,他研究了S_N2反应中空间效应和电子效应之间的相互作用。

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