Synthesis and Characterization of Pentaarylated [60]Fullerene Coordinated Complexes [(η2-Ar5C60H)M(PPh3)2] (M = Pt, Pd) and an ab initio Study on Their Isomerism

2003 ◽  
Vol 2003 (11) ◽  
pp. 21640-2169
Author(s):  
Li-Cheng Song ◽  
Peng-Chong Liu ◽  
Qing-Mei Hu ◽  
Zhenyang Lin ◽  
Yi-Bo Wang
Keyword(s):  
Ab Initio ◽  
Synthesis And Characterization ◽  
Ab Initio Study

scholarly journals Spectroscopic characterization of the complex of vinyl radical and carbon dioxide: Matrix isolation and ab initio study

2017 ◽  
Vol 147 (18) ◽  
pp. 184301 ◽  
Author(s):  
Sergey V. Ryazantsev ◽  
Daniil A. Tyurin ◽  
Vladimir I. Feldman ◽  
Leonid Khriachtchev
Keyword(s):  
Carbon Dioxide ◽  
Ab Initio ◽  
Matrix Isolation ◽  
Spectroscopic Characterization ◽  
Ab Initio Study ◽  
Vinyl Radical

Ab initio study on the characterization of N2O4 isomers

1998 ◽  
Vol 432 (1) ◽  
pp. 55-62 ◽  
Author(s):  
Xuefeng Wang ◽  
Qi-Zong Qin ◽  
Kangnian Fan
Keyword(s):  
Ab Initio ◽  
Ab Initio Study

Ab initio study of the O4H+ novel species: spectroscopic fingerprints to aid its observation

2015 ◽  
Vol 17 (24) ◽  
pp. 16023-16032 ◽  
Author(s):  
F. George D. Xavier ◽  
Rámon Hernández-Lamoneda
Keyword(s):  
Ab Initio ◽  
Novel Species ◽  
Spectroscopic Properties ◽  
The Novel ◽  
Ab Initio Study

A detailed ab initio characterization of the structural, energetic and spectroscopic properties of the novel O4H+ species is presented.

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