Ab Initio Study of the Effect of Solvation on the Electronic Spectra of Formamide andN-Methylacetamide

1998 ◽  
Vol 102 (52) ◽  
pp. 10791-10797 ◽  
Author(s):  
Nicholas A. Besley ◽  
Jonathan D. Hirst
Keyword(s):  
Ab Initio ◽  
Electronic Spectra ◽  
Ab Initio Study

Electronic spectra of H2C2nH+ radicals (n=2–6): An ab initio study

2009 ◽  
Vol 74 (5) ◽  
pp. 1090-1094 ◽  
Author(s):  
Lihui Jiang ◽  
Chunzhang Wang ◽  
Junfeng Li ◽  
Xugeng Guo ◽  
Jinglai Zhang
Keyword(s):  
Ab Initio ◽  
Electronic Spectra ◽  
Ab Initio Study

An ab initio study on the vibrational and electronic spectra of the molybdenum–sulfur clusters with Mo2OnS4−n(n=0–4) core

1999 ◽  
Vol 460 (1-3) ◽  
pp. 27-35 ◽  
Author(s):  
Liming Wu ◽  
Yongfan Zhang ◽  
Jianming Hu ◽  
Lixin Zhou ◽  
Junqian Li
Keyword(s):  
Ab Initio ◽  
Electronic Spectra ◽  
Ab Initio Study

Electronic spectra of the linear polyyne cations HC2nH+ (n=2–8): An ab initio study

2009 ◽  
Vol 131 (14) ◽  
pp. 144307 ◽  
Author(s):  
Jinglai Zhang ◽  
Xugeng Guo ◽  
Zexing Cao
Keyword(s):  
Ab Initio ◽  
Electronic Spectra ◽  
Ab Initio Study

Electronic Spectra of Linear Isoelectronic Clusters C2n+1S and C2n+1Cl+(n= 0−4):  An ab Initio Study

2006 ◽  
Vol 110 (34) ◽  
pp. 10324-10329 ◽  
Author(s):  
Jinglai Zhang ◽  
Wenpeng Wu ◽  
Lianbin Wang ◽  
Xing Chen ◽  
Zexing Cao
Keyword(s):  
Ab Initio ◽  
Electronic Spectra ◽  
Ab Initio Study
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