Structure of liquid CdTe alloys using local evanescent core pseudopotential

DALGIÇ S., ÇOLAKOĞULLARI M.

OPTOELECTRONICS AND ADVANCED MATERIALS-RAPID COMMUNICATIONS, cilt.1, sa.3, ss.108-112, 2007 (SCI-Expanded) identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 1 Sayı: 3
  • Basım Tarihi: 2007
  • Dergi Adı: OPTOELECTRONICS AND ADVANCED MATERIALS-RAPID COMMUNICATIONS
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED)
  • Sayfa Sayıları: ss.108-112
  • Trakya Üniversitesi Adresli: Evet

Özet

There are presented the results of a test of transferability of the local evanescent core (LEC) pseudopotential proposed by Fiolhais et. al. to the chalcogen liquid alloys. The test is a comparison of the static structure of simple liquid metals and liquid CdTe alloys with the experimental results. The structural properties are calculated using the Variational Modified Hypernetted Chain (VMHNC) liquid state theory. It has been found that the liquid structure obtained using the LEC pseudopotential is in better agreement with the experimental data than other potentials.