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SOLVATED ELECTRON IN LIQUID METHANOL. AN EXAMPLE OF A STATISTICAL SPECIES IN CHEMISTRY

机译:液体甲醇中的溶剂化电子。化学统计物种的一个例子

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摘要

The methods of analysis of the statistical ensembles of trapping sites, before and after electron localization, for electrons in disordered media are surveyed. The review covers the computer-search methods for pre-existing traps in polar matrices, random field theory of disordered polar matrices and the path integral simulations of solvated electron. The common picture provided by all these methods is emphasized: the solvated electron is a unique in chemistry statistical species characterized by statistical distributions of the structural parameters, energy states, reactivity, etc. The numerical examples are provided by the simulations of the trapping sites and the solvated electron in liquid methanol.
机译:考察了电子定位前后电子在无序介质中的俘获位点统计集合的分析方法。该综述涵盖了极性矩阵中现有陷阱的计算机搜索方法,无序极性矩阵的随机场理论以及溶剂化电子的路径积分模拟。强调了所有这些方法提供的共同图片:溶剂化电子在化学统计物种中是独特的,其特征在于结构参数,能态,反应性等的统计分布。液态甲醇中的溶剂化电子。

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