Identification of valence electronic states of aqueous acetic acid in acid-base equilibrium using site-selective X-ray emission spectroscopy

被引：34

作者：

Horikawa, Yuka ^{[1
,2
]}

Tokushima, Takashi ^{[1
]}

Harada, Yoshihisa ^{[1
,3
,4
]}

Takahashi, Osamu ^{[5
]}

Chainani, Ashish ^{[1
]}

Senba, Yasunori ^{[6
]}

Ohashi, Haruhiko ^{[6
]}

Hiraya, Atsunari ^{[2
]}

Shin, Shik ^{[1
,7
]}

机构：

[1] RIKEN, SPring 8, Sayo, Hyogo 6795148, Japan

[2] Hiroshima Univ, Dept Phys Sci, Hiroshima 7398526, Japan

[3] Univ Tokyo, Dept Appl Chem, Bunkyo Ku, Tokyo 1138656, Japan

[4] CREST, JST, Kawaguchi, Saitama 3320012, Japan

[5] Hiroshima Univ, Dept Chem, Hiroshima 7398526, Japan

[6] JASRI, SPring 8, Koutosayo, Hyogo 6795198, Japan

[7] Univ Tokyo, Inst Solid State Phys, Chiba 2778581, Japan

来源：

PHYSICAL CHEMISTRY CHEMICAL PHYSICS | 2009年 / 11卷 / 39期

关键词：

CHEMICAL-SHIFTS; WATER;

D O I：

10.1039/b910039c

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Occupied valence electronic structures in the neutral and the anionic forms of aqueous acetic acid and their pH dependence under ambient condition are identified for the first time exploiting the site-selectivity of resonant X-ray emission spectroscopy (XES) in combination with calculation based on density functional theory (DFT).

引用

页码：8676 / 8679

页数：4

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