J Mater Sci Technol ›› 1993, Vol. 9 ›› Issue (1): 65-67.

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Computerized Simulation of Structure of NaAIO_2 Melt

Chi XU Ming LI Nianyi CHEN Shanghai Institute of Metallurgy,Academia Sinica,Shanghai,200050,China   

  • Received:1993-01-28 Revised:1993-01-28 Online:1993-01-28 Published:2009-10-10

Abstract: The structure of NaAlO_2 melt has been studied by computerized simulation using Monte Carlo method.The radial distribution functions and Local structure of this melt are calculated.It has been found that NaAlO_2 melt contains ionic clusters formed by corner-sharing AlO_4 tetrahedra,sodium ions and xNa~+.yO~(2-) ionic clusters.

Key words: computerized simulation, N_aAlO_2 melt, Monte Carlo method