Valence photoionization and energetics of vanillin, a sustainable feedstock candidate

X Wu, X Zhou, S Bjelic, P Hemberger… - The Journal of Physical …, 2021 - ACS Publications
We studied the valence photoionization of vanillin by photoelectron photoion coincidence
spectroscopy in the 8.20–19.80 eV photon energy range. Vertical ionization energies by …

Ionization energy and thermochemistry of CF2Cl2 determined from threshold photoelectron spectroscopy

H Zhang, T Yu, X Wu, Y Chen, B Shan, X Zhou… - Chemical Physics …, 2021 - Elsevier
In this work, we performed a joint study of threshold photoelectron spectroscopy and density
functional calculations on photoionization of CF 2 Cl 2. Using the optimized geometries and …

Ro-vibrational Distribution of NO+ Dissociated from NO2+ Ions in the a3B2 and b3A2 States: A Slow “Impulsive” Dissociation Example Revealed from …

T Yu, X Wu, X Ning, Y Chen, X Zhou… - The Journal of …, 2021 - ACS Publications
To clarify the contentions about dissociative photoionization mechanism of nitrogen dioxide
via the a3B2 and b3A2 ionic states, a new threshold photoelectron–photoion coincidence …

Threshold photoelectron spectroscopy and density functional theory studies on the CF2Cl2 ionization energies towards the B2B1 and C2A1 ionic states

B Shan, H Zhang, T Yu, Y Chen, X Wu, X Zhou… - Journal of Molecular …, 2021 - Elsevier
Threshold photoelectron spectroscopy and density functional theory calculations were
performed on dichlorodifluoromethane (CF 2 Cl 2) in the photon energy range of 11.70 …

[PDF][PDF] Threshold photoelectron spectrum of CF2Cl2 in photon energy range of 13.9–15.1 eV

B Shan, X Yang, T Yu, Y Chen, N Zhang… - Chinese Journal of …, 2024 - lclab.ustc.edu.cn
Threshold photoelectron spectroscopy of dichlorodifluoromethane (CF2Cl2) has been re-
investigated using a combination of photoelectron-photoion coincidence measurement and …

三氯化硼离子C2A′′ 2 态光电子谱的理论研究

宁小寒, 于同坡, 陈燕, 单宝坤, 周晓国, 刘世林 - 量子电子学报, 2021 - lk.hfcas.ac.cn
应用密度泛函理论对BCl+ 3 离子C2A′′ 2 态的电子能谱进行了深入研究. 在aug-cc-pvtz
基组下, 分别使用PBE0,! B97XD, M06-2X 三种泛函优化了中性BCl3 分子, BCl+ 3 …

Theoretical study on photoelectron spectrum of BCl+ 3 cation in C2A′′ 2 state

N Xiaohan, YU Tongpo, C Yan, S Baokun… - Chinese Journal of …, 2021 - lk.hfcas.ac.cn
Density functional theory has been applied to in-depth study on photoelectron spectrum of
BCl+ 3 cation in the C2A′′ 2 state. With the aug-cc-pvtz basis set, the geometries of …