The liquid structure of CdTe alloy using the ameam potentials

DALGIÇ S., ŞENGÜL S., Kalayci S.

Journal of Optoelectronics and Advanced Materials, cilt.7, sa.4, ss.2001-2011, 2005 (SCI-Expanded, Scopus) identifier

  • Yayın Türü: Makale / Özet
  • Cilt numarası: 7 Sayı: 4
  • Basım Tarihi: 2005
  • Dergi Adı: Journal of Optoelectronics and Advanced Materials
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.2001-2011
  • Anahtar Kelimeler: Analytic modified embedded atom method, Cadmium telluride, Liquid structure, Stillinger-Weber potential
  • Trakya Üniversitesi Adresli: Evet

Özet

The structure of molten cadmium telluride have been calculated using the integral equation theories with the efective pair potentials based on the analytic modified embedded atom method (AMEAM). The pair interactions are described with the semi-empirical potential functions recently proposed Hu and co-workers. All the potential parameters for pure components are determined by fitting both liquid and solid state properties. The structural properties of liquid Cd-Te equiatomic alloy have been obtained using the Variational Modified Hypernetted Chain liquid state theory. The results of partial pair distribution functions are compared with the neutron diffraction data and those obtained by Stillinger-Weber semi-empirical potential.