We carried out NPT ensemble classical molecular dynamics simulation of water in solid, liquid and gaseous state. The simulations were performed for two density cases-normal (r ¼ 1 g/cm 3 ) and lowered density (r ¼ 0:25 g/cm 3 ), for several values of temperature. The calculated structural and dynami
✦ LIBER ✦
Molecular dynamics study of structure and graphitization process of nanodiamonds
✍ Scribed by A. Bródka; Ł. Hawełek; A. Burian; S. Tomita; V. Honkimäki
- Publisher
- Elsevier Science
- Year
- 2008
- Tongue
- English
- Weight
- 882 KB
- Volume
- 887
- Category
- Article
- ISSN
- 0022-2860
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