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Thermochemistry and Infrared Spectroscopy of Neutral and Cationic Iron-Polycyclic Aromatic Hydrocarbon Complexes of Astrophysical Interest: Fundamental Density Functional Theory Studies

机译：中性和阳离子铁 - 多环芳烃络合物的热化学和红外光谱分式的天体物理兴趣：基本密度泛函理论研究

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1. Thermochemistry and Infrared Spectroscopy of Neutral and Cationic Iron-Polycyclic Aromatic Hydrocarbon Complexes of Astrophysical Interest:Fundamental Density Functional Theory Studies [J] . Aude Simon, Christine Joblin The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2007,第39期

机译：天文学兴趣的中性和阳离子铁-多环芳烃配合物的热化学和红外光谱：基本密度泛函理论研究
2. The far-infrared spectrum of azulene and isoquinoline and supporting anharmonic density functional theory calculations to high resolution spectroscopy of polycyclic aromatic hydrocarbons and derivatives [J] . Manuel Goubet, Olivier Pirali The Journal of Chemical Physics . 2014,第4期

机译：z和异喹啉的远红外光谱和支持非谐密度泛函理论计算的多环芳烃及其衍生物的高分辨率光谱
3. UV-vis spectra of singlet state cationic polycyclic aromatic hydrocarbons: Time-dependent density functional theory study [J] . Justyna Dominikowska, Malgorzata Domagala, Marcin Palusiak The Journal of Chemical Physics . 2014,第4期

机译：单重态阳离子多环芳烃的紫外可见光谱：随时间变化的密度泛函理论研究
4. Electron-accepting potential of solvents determines photolysis rates of polycyclic aromatic hydrocarbons: Experimental and density functional theory study [C] . Jianping Shao, Jingwen Chen, Qing Xie, ICMSI;International conference of molecular simulations and applied informatics technologies . 2010

机译：溶剂的电子接受势决定多环芳烃的光解速率：实验和密度泛函理论研究
5. Study of the structure and reactivity of the radical cations and anions of cysteine, its derivatives, and cysteine-containing peptides using ion-molecule reactions, infrared multi-photon dissociation spectroscopy, and density functional theory calculations. [D] . Osburn, Sandra. 2013

机译：使用离子分子反应，红外多光子解离光谱和密度泛函理论计算研究半胱氨酸，其衍生物和含半胱氨酸的肽的自由基阳离子和阴离子的结构和反应性。
6. Study of Electronic and Vibrational Structures ofReduced Neutral and Oxidized Ni3(dpa)4X2 Using Density Functional Theory and Raman Spectroscopy [O] . Wei-Hao Chen, Chen-Wei Huang, Bo-Han Wu, 2020

机译：电子振动结构的研究密度泛函理论和拉曼光谱法还原中性和氧化的Ni3（dpa）4X2
7. Exciting polycyclic aromatic hydrocarbon vibrations : infrared absorption spectroscopy of astrophysically relevant jet-cooled neutral and cationic polycyclic aromatic hydrocarbons [O] . Piest Johann Arend 2002

机译：令人兴奋的多环芳烃振动：天体相关喷射冷却的中性和阳离子多环芳烃的红外吸收光谱

Thermochemistry and Infrared Spectroscopy of Neutral and Cationic Iron-Polycyclic Aromatic Hydrocarbon Complexes of Astrophysical Interest: Fundamental Density Functional Theory Studies

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