Art

J-GLOBAL ID：201402254535092455   Reference number：14A1490568

Temperature effects on prevalent structures of hydrated Fe⁺ complexes: Infrared spectroscopy and DFT calculations of Fe⁺(H₂O)_n (n = 3-8)

水和Fe⁺錯体の支配的な構造に対する温度効果 Fe⁺(H₂O)_n (n = 3-8)に関する赤外分光およびDFT計算

Author (6)： OHASHI Kazuhiko (Dep. of Chemistry, Fac. of Sciences, Kyushu Univ., Hakozaki, Fukuoka 812-8581, JPN) ,  SASAKI Jun (Dep. of Chemistry, Graduate School of Sciences, Kyushu Univ., Hakozaki, Fukuoka 812-8581, JPN) ,  YAMAMOTO Gun (Dep. of Chemistry, Graduate School of Sciences, Kyushu Univ., Hakozaki, Fukuoka 812-8581, JPN) ,  JUDAI Ken (Inst. for Molecular Sci., Myodaiji, Okazaki 444-8585, JPN) ,  NISHI Nobuyuki (Inst. for Molecular Sci., Myodaiji, Okazaki 444-8585, JPN) ,  SEKIYA Hiroshi (Dep. of Chemistry, Fac. of Sciences, Kyushu Univ., Hakozaki, Fukuoka 812-8581, JPN)
Material： Journal of Chemical Physics  (J Chem Phys)
Volume： 141  Issue： 21  Page： 214307-214307-10  Publication year： Dec. 07, 2014 
JST Material Number： C0275A  ISSN： 0021-9606  CODEN： JCPSA6  Document type： Article
Article type： 原著論文  Country of issue： United States (USA)  Language： ENGLISH (EN)

Thesaurus term： hydration ,  *hydrate ,  *iron complex ,  *temperature dependence ,  *infrared spectrum ,  *calculation ,  *density functional method ,  quadruple mass spectrometer ,  Action Spectrum ,  solvation ,  dependence ,  free energy ,  enthalpy ,  size dependence
Semi thesaurus term： *temperature effect ,  *density functional theory calculation ,  photodissociation spectrum

JST classification (1)： Infrared and Raman spectra of complex molecules  (BH06034J)

Terms in the title (7)： 水和 ,  錯体 ,  支配 ,  温度効果 ,  H2O ,  赤外分光 ,  DFT計算