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Force and density study on the chemical reaction process NH2 + H .fwdarw. NH3

✍ Scribed by Nakatsuji, H.; Koga, T.; Kondo, K.; Yonezawa, T.


Book ID
127115612
Publisher
American Chemical Society
Year
1978
Tongue
English
Weight
931 KB
Volume
100
Category
Article
ISSN
0002-7863

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The reaction Y + + NH, + Y'NH + H, was theoretically investigated by ab initio MO methods. Two possible pathways (1-1 H, loss and 1-2 H, loss) on the singlet potential energy surface and reaction mechanism were examined and discussed. The singlet and triplet PESs of this reaction system were compare