ChemInform Abstract: AB INITIO CALCULATIONS OF THE POTENTIAL ENERGY SURFACE OF THE REACTION OF SINGLET METHYLENE WITH THE HYDROGEN MOLECULE

1979 ◽  
Vol 10 (28) ◽  
Author(s):  
H. KOLLMAR ◽  
V. STAEMMLER
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Hydrogen Molecule ◽  
Energy Surface ◽  
Singlet Methylene

An analytical six‐dimensional potential energy surface for (HF)2 from ab initio calculations

1988 ◽  
Vol 89 (5) ◽  
pp. 3002-3007 ◽  
Author(s):  
P. R. Bunker ◽  
Manfred Kofranek ◽  
Hans Lischka ◽  
Alfred Karpfen
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Energy Surface

A global potential energy surface of Ar2H+ based on ab initio calculations

2002 ◽  
Vol 117 (6) ◽  
pp. 2592-2598 ◽  
Author(s):  
Jun Yan Qu ◽  
Wei Li ◽  
Rui Guo ◽  
Xin Sheng Zhao
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Energy Surface
Sign in / Sign up

Export Citation Format

Share Document