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JOURNAL OF SYNTHETIC CRYSTALS ›› 2001, Vol. 30 ›› Issue (2): 198-202.

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Investigation of Chemical Bond Properties and MossbauerIsomerShifts in Magnetoplumbite Type Compound LaMAl11O19(M=Mg,Fe)

GAO Fa-Ming;LI Dong-Chun;ZHANG Si-Yuan   

  • Online:2001-02-15 Published:2021-01-20

Abstract: The chemical bond properties of the magnetoplumbite type compound LaMAl11O19(M=Mg,Fe) have been studied by using the average band-gap model of the complex crystal chemical bond.The results show that covalency of La-O bond is only 3;,but 4f1 site has very high covalent character in each bond.The covalency for each bond obeys the following order:La-O<Al(5)-O<Al(1)-O<Al(4)-O<Al(2)-O<Al(3)-O<M-O.The anisotropy character in 2d site and 4e site of the crystals is revealed by calculating the chemical bond parameters.Mossbauer isomer shifts of Fe2+ ion in LaFeAl11O19 and Eu3+ ion in LaMgAl11O19 are calculated by using the chemical surrounding facter,h,definited by covalency and electronic polarizability,and the results are in agreement with the experimental values.

Key words: The chemical bond properties of the magnetoplumbite type compound LaMAl11O19(M=Mg,Fe) have been studied by using the average band-gap model of the complex crystal chemical bond.The results show that covalency of La-O bond is only 3;,but 4f1 site has very high covalent character in each bond.The covalency for each bond obeys the following order:La-O<Al(5)-O<Al(1)-O<Al(4)-O<Al(2)-O<Al(3)-O<M-O.The anisotropy character in 2d site and 4e site of the crystals is revealed by calculating the chemical bond parameters.Mossbauer isomer shifts of Fe2+ ion in LaFeAl11O19 and Eu3+ ion in LaMgAl11O19 are calculated by using the chemical surrounding facter,h,definited by covalency and electronic polarizability,and the results are in agreement with the experimental values.

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