Defect interactions in ionic fluorite structures. I. Pair clusters in CaF2doped by YF3
作者： A R Allnatt , P S Yuen
DOI: 10.1088/0022-3719/8/14/002
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摘要: For pt.I see ibid., vol.8, p.2199 (1975). The mass action equilibrium between neutral defect pairs and 2:2:2 clusters was studied for Y3+-doped CaF2 using the theoretical value of binding energy. formation from anion interstitials substitutional Y3+ ions included. coulomb interactions among themselves with other species allowed in a second virial coefficient approximation an idealized model at concentrations up to 5-6%. It concluded that effects were sufficiently small higher statistical mechanics is likely be dominated by larger rather than slight ordering effect coulombic here.
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sci-hub.se 参考文章(21)
Harold L. Friedman, Ionic Solution Theory: Based on Cluster Expansion Methods ,(2013)
Electron Nuclear Double Resonance in Calcium Fluoride Containing Yb$^{3+}$ and Ce$^{3+}$ in Tetragonal Sites Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences. ,vol. 308, pp. 403- 431 ,(1969) , 10.1098/RSPA.1969.0017
K. V. Rao, A. Smakula, Dielectric Properties of Alkaline Earth Fluoride Single Crystals Journal of Applied Physics. ,vol. 37, pp. 319- 323 ,(1966) , 10.1063/1.1707834
Richard H. Heist, Francis K. Fong, Maxwell-Boltzmann Distribution ofM3+-F−Interstitial Pairs in Fluorite-Type Lattices Physical Review B. ,vol. 1, pp. 2970- 2976 ,(1970) , 10.1103/PHYSREVB.1.2970
A. B. Lidiard, Ionic Conductivity of Impure Polar Crystals Physical Review. ,vol. 94, pp. 29- 37 ,(1954) , 10.1103/PHYSREV.94.29
W. Bollmann, R. Reimann, Concentration and mobility of interstitial fluorine ions in CaF2 Physica Status Solidi (a). ,vol. 16, pp. 187- 196 ,(1973) , 10.1002/PSSA.2210160120
Francis K. Fong, On the origin of cubic sites of trivalent rare‐earth ions in alkaline earth fluorides Journal of Chemical Physics. ,vol. 61, pp. 1604- 1604 ,(1974) , 10.1063/1.1682148
A. R. Allnatt, Morrel H. Cohen, Statistical Mechanics of Defect‐Containing Solids. II. Ionic Crystals The Journal of Chemical Physics. ,vol. 40, pp. 1871- 1890 ,(1964) , 10.1063/1.1725418
W. Bollmann, P. Görlich, W. Hauk, H. Mothes, Ionic conduction of pure and doped CaF2 and SrF2 crystals Physica Status Solidi (a). ,vol. 2, pp. 157- 170 ,(1970) , 10.1002/PSSA.19700020120
A. R. Allnatt, E. Loftus, Physical cluster theory of point defect interactions. I. General formalism The Journal of Chemical Physics. ,vol. 59, pp. 2541- 2549 ,(1973) , 10.1063/1.1680370