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S. DALGIC1,* , M. COLAKOGULLARI1
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.
Liquid Cadmium Telluride, Local evanescent core, Liquid structure.
S. DALGIC, M. COLAKOGULLARI, Structure of liquid CdTe alloys using local evanescent core pseudopotential, Optoelectronics and Advanced Materials - Rapid Communications, 1, 3, March 2007, pp.108-112 (2007).
Submitted at: Nov. 12, 2006
Accepted at: Feb. 14, 2007
Optoelectronics and Advanced Materials - Rapid Communications
(2024): Impact Factor = 0.4 - Journal Citation Reports (Clarivate Analytics, 2025)
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