In this study, three model functions, developed recently for carbon species, were analyzed comparatively. All three functions are based on two-body and angle-dependent three-body interactions, and have been parametrized to reproduce various properties of graphite and diamond crystals. Limitations an
Model functions for carbon in calculating properties of small clusters
โ Scribed by Timur Halicioglu
- Publisher
- Elsevier Science
- Year
- 1991
- Tongue
- English
- Weight
- 570 KB
- Volume
- 185
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
โฆ Synopsis
Received27 4pril
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