Static structure of liquid K-Sb alloys using the MAEAM potentials
Küçük Resim Yok
Tarih
2007
Yazarlar
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
Natl Inst Optoelectronics
Erişim Hakkı
info:eu-repo/semantics/closedAccess
Özet
The structure of K-Sb liquid alloys at different compositions of Sb have been obtained using the modified analytic EAM (MAEAM) based effective pair potentials in conjunction with the Variational Hypernetted Chain (VMHNC) liquid state theory. The effective pair potentials are constructed from the MAEAM potential functions which are parameterized with fitting to both solid and liquid state properties of pure metals. The partial pair correlation functions and total static structure factor in liquid KSb alloys are computed and than compared with experiments and the results of MD studies. The overall agreement has been found in reported works.
Açıklama
5th International Romanian Conference on Advanced Materials -- SEP 11-14, 2006 -- Bucharest Magurele, ROMANIA
Anahtar Kelimeler
Liquid K-Sb Alloys, Structure, Modified Analytic EAM Potentials (MAEAM), Embedded-Atom-Method, Initio Molecular-Dynamics, Potassium-Antimony Alloys, Transition-Metals, Thermodynamic Properties, Neutron-Scattering, Earth Metals, Bcc Metals, Model
Kaynak
Journal Of Optoelectronics And Advanced Materials
WoS Q Değeri
Q3
Scopus Q Değeri
Q4
Cilt
9
Sayı
6
