Reduced-size polarized basis sets for calculations of molecular electric properties. II. Simulation of the Raman spectra

2004 ◽  
Vol 26 (2) ◽  
pp. 154-159 ◽  
Author(s):  
Roma E. Oakes ◽  
Steven E. J. Bell ◽  
Zuzana Benkova ◽  
Andrzej J. Sadlej
Keyword(s):  
Raman Spectra ◽  
Electric Properties ◽  
Basis Sets ◽  
Polarized Basis Sets

Reduced–size polarized basis sets for calculations of molecular electric properties. III. Second–row atoms

2005 ◽  
Vol 113 (4) ◽  
pp. 238-247 ◽  
Author(s):  
Zuzana Benkova ◽  
Andrzej J. Sadlej ◽  
Roma E. Oakes ◽  
Steven E. J. Bell
Keyword(s):  
Electric Properties ◽  
Basis Sets ◽  
Polarized Basis Sets

Reduced-size polarized basis sets for calculations of molecular electric properties. I. The basis set generation

2004 ◽  
Vol 26 (2) ◽  
pp. 145-153 ◽  
Author(s):  
Zuzana Benkova ◽  
Andrzej J. Sadlej ◽  
Roma E. Oakes ◽  
Steven E. J. Bell
Keyword(s):  
Electric Properties ◽  
Basis Set ◽  
Basis Sets ◽  
Polarized Basis Sets
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