scholarly journals First principles calculation of the potential energy surface for the lowest-quartet state of H3 and modelling by the double many-body expansion method

2000 ◽  
Vol 2 (11) ◽  
pp. 2471-2480 ◽  
Author(s):  
P. E. Abreu ◽  
A. J. C. Varandas
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
First Principles ◽  
Energy Surface ◽  
Expansion Method ◽  
First Principles Calculation ◽  
Quartet State ◽  
Many Body

scholarly journals Recalibrated Double Many-Body Expansion Potential Energy Surface and Dynamics Calculations for HN2

2007 ◽  
Vol 111 (7) ◽  
pp. 1172-1178 ◽  
Author(s):  
P. J. S. B. Caridade ◽  
L. A. Poveda ◽  
S. P. J. Rodrigues ◽  
A. J. C. Varandas
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Many Body
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