Physics – Computational Physics
Scientific paper
2007-04-18
Chin. Phys. Lett. 23 (2006), 1068-1071
Physics
Computational Physics
4 pages, 3 figures
Scientific paper
Linear thermal expansion coefficient (TEC) and specific heat of Ti bulk is investigated by means of molecular dynamics simulation. Elastic Minimum Image Convention of periodic boundary conditions is introduced to allow the bulk to adjust its size according to the new temporarily fixed temperature. The TEC and the specific heat of Ti are compared to the available theoretical and experimental data.
Guvenc Ziya B.
Hippler Rainer
Hundur Yakup
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