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Empirical Interatomic Potential for Carbon, with Applications to Amorphous Carbon

✍ Scribed by Tersoff, J.


Book ID
120556974
Publisher
The American Physical Society
Year
1988
Tongue
English
Weight
203 KB
Volume
61
Category
Article
ISSN
0031-9007

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Semi-empirical potential energy surface
✍ Kwok L. Yip; Donald R. Franceschetti πŸ“‚ Article πŸ“… 1975 πŸ› Elsevier Science 🌐 English βš– 222 KB

Potrntial energy surfxcs were obtained in an estendcd IIi.ickel culculaGon for the lowest ' A1 und ' 82 states of the ferrous porphin-CO compiles. The relcv~nce of these surfaces to cspcrimental kinetic data is discussed.