The calculation of P-T diagrams of Al using molecular dynamic simulation

Ciftci Y., Ugurluoglu N., Colakoglu K., Demircioglu Z.

6th International Conference of the Balkan-Physical-Union, İstanbul, Türkiye, 22 - 26 Ağustos 2006, cilt.899, ss.590 identifier identifier

  • Yayın Türü: Bildiri / Tam Metin Bildiri
  • Cilt numarası: 899
  • Doi Numarası: 10.1063/1.2733331
  • Basıldığı Şehir: İstanbul
  • Basıldığı Ülke: Türkiye
  • Sayfa Sayıları: ss.590
  • Gazi Üniversitesi Adresli: Evet

Özet

In this work, molecular dynamic (MD) simulations are performed for Al based on the embedded atom method (EAM). P-T diagrams are determined, the bulk moduli, the radial distribution functions, are also calculated. The computed thermodynamic parameters are found, generally, to be in good agreement with the available experimental data.