Comparative semiempirical, ab initio, and density functional theory study on the thermodynamic properties of linear and branched perfluoroalkyl sulfonic acids/sulfonyl fluorides, perfluoroalkyl carboxylic acid/acyl fluorides, and perhydroalkyl sulfonic acids, alkanes, and alcohols
Comparative semiempirical, ab initio, and density functional theory study on the thermodynamic properties of linear and branched perfluoroalkyl sulfonic acids/sulfonyl fluorides, perfluoroalkyl carboxylic acid/acyl fluorides, and perhydroalkyl sulfonic acids, alkanes, and alcohols
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对直链和支链全氟烷基磺酸/磺酰氟、全氟烷基羧酸/酰氟以及全氢烷基磺酸、烷烃和醇的热力学性质进行比较半经验、从头计算和密度泛函理论研究
DOI：
10.1016/j.theochem.2009.11.015
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发表时间：
2010
影响因子：
--
通讯作者：
K. Forest
中科院分区：
文献类型：
--
作者：
S. Rayne;K. Forest
影响因子：
1.9
作者：
H. Lehmler;V. R. Rama Rao;D. Nauduri;J. Vargo;S. Parkin
通讯作者：
H. Lehmler;V. R. Rama Rao;D. Nauduri;J. Vargo;S. Parkin