The liquid structure of CdTe alloy using the ameam potentials
Küçük Resim Yok
Tarih
2005
Yazarlar
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
Natl Inst Optoelectronics
Erişim Hakkı
info:eu-repo/semantics/closedAccess
Özet
The structure of molten cadmium telluride have been calculated using the integral equation theories with the effective 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.
Açıklama
2nd International Workshop on Amorphous and Nanostructured Chalcogenides -- JUN 20-24, 2005 -- Sinaia, ROMANIA
Anahtar Kelimeler
Cadmium Telluride, Liquid Structure, Analytic Modified Embedded Atom Method, Stillinger-Weber Potential, Embedded-Atom-Method, Rare-Earth-Metals, Hcp Metals, Thermodynamic Properties, Molecular-Dynamics, Transition-Metals, Method Model, Computer-Simulation, Defect Properties, Alkali-Metals
Kaynak
Journal Of Optoelectronics And Advanced Materials
WoS Q Değeri
Q2
Scopus Q Değeri
Q4
Cilt
7
Sayı
4
