Relativistic Density Functional Theory Study on the 139La Chemical Shifts and Electronic Spectra of La2 @ C72

2009 ◽  
Vol 6 (2) ◽  
pp. 434-438 ◽  
Author(s):  
Peng Jin ◽  
Weihong Mi ◽  
Ce Hao ◽  
Shenmin Li ◽  
Zhanxian Gao
Keyword(s):  
Density Functional Theory ◽  
Electronic Spectra ◽  
Density Functional ◽  
Chemical Shifts ◽  
Density Functional Theory Study ◽  
Functional Theory

scholarly journals Oxoperoxo Vanadium(V) Complexes ofl-Lactic Acid: Density Functional Theory Study of Structure and NMR Chemical Shifts

2008 ◽  
Vol 47 (16) ◽  
pp. 7317-7326 ◽  
Author(s):  
Licínia L. G. Justino ◽  
M. Luísa Ramos ◽  
Fernando Nogueira ◽  
Abilio J. F. N. Sobral ◽  
Carlos F. G. C. Geraldes ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Lactic Acid ◽  
Density Functional ◽  
Chemical Shifts ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Nmr Chemical Shifts
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