New potential energy function for four-atom reactions. Application to OH+H(2)
LAGROBO is a model for fitting analytical potential energy surfaces (PES) in which the potential function is expressed as a many-process expansion of rotating bond order (ROBO) potentials. The model is developed in bond order (BO) coordinates and shows several advantages. In particular, it can be us...
| Автори: | , |
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| Формат: | Journal article |
| Мова: | English |
| Опубліковано: |
1998
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