Study on the Chemical Bond Propertiesin Pr1-xKxMnO3 (0.0 ≤ x ≤0.15)
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Abstract
Chemical bond properties of Pr1-xKxMnO3 have been studied using semiempirical method. This method is the generalization of the dielectric description theory delivered by Phillips,Van Vechten and Levine. The results indicate that with the increasing K doping level, the bond covalencies of Pr-O and K-O slighhy decrease, whereas those of Mn-O increase. The bond covalencies of Mn-O is larger than those of Pr-O and K-O. The bond susceptibilities show above regularity as well. This is in good agreement with the experimental fact that the bond distance of Mn-O bond is shorter than those of Pr(K)-O. The macroscopic linear susceptibility slightly decreases With the increasing K doping level.
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