Charge Density Methods in Hydrogen Bond Studies
Charge Density Methods in Hydrogen Bond Studies
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DOI：
10.1007/978-3-642-30802-4_28
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发表时间：
2010
期刊：
影响因子：
--
通讯作者：
J. Overgaard;B. Iversen
中科院分区：
文献类型：
--
作者：
J. Overgaard;B. Iversen
简要概述了氢键的历史，并总结了目前用于理解和研究氢键的描述性元素。具体的挑战时出现的氢键系统的实验电荷密度的研究进行了解释和一些最近的和重要的电荷密度的研究已被选中，以说明显着的影响，实验电荷密度建模继续有理解的性质的氢键，无论是在静电，较长的氢键和在很短的，强的氢键。
The history of hydrogen bonding is briefly outlined and the current descriptive elements used in the understanding and the study of hydrogen bonds are summarized. The specific challenges that emerge when making experimental charge density studies of hydrogen bonded systems are explained and a number of recent and important charge density studies have been selected to illustrate the significant impact that the experimental charge density modeling continues to have on the understanding of the nature of the hydrogen bonding, both in the electrostatic, longer hydrogen bonds and in the very short, strong hydrogen bonds.