XU Shi-you, JIA Xiu-hua, DING Cong-wen, YANG Jun. Topological Index mE and Physicochemical Properties of Inorganic Compounds[J]. Journal of Beijing University of Technology, 2005, 31(1): 81-85.
    Citation: XU Shi-you, JIA Xiu-hua, DING Cong-wen, YANG Jun. Topological Index mE and Physicochemical Properties of Inorganic Compounds[J]. Journal of Beijing University of Technology, 2005, 31(1): 81-85.

    Topological Index mE and Physicochemical Properties of Inorganic Compounds

    • The point value δi of Randic topological index was modified and topological index mE of valence electron orbit energy was thereby formed for predicting physicochemical properties of inorganic compounds. Utilizing their zero and first order index correlating to pKa1 of inorganic hydrides, lattice energy, enthalpy of formation, hydrated energy and nuclear distance, several regression equations were suggested. Their related coefficient (index) is 0.994 4(0.995 8),0.996 7(0.997 1), 0.981 6(0.981 6), 0.979 1(0.979 5) and 0.995 3 (0.995 3), respectively, which showed that the results meet the good and excellent standards.
    • loading

    Catalog

      Turn off MathJax
      Article Contents

      /

      DownLoad:  Full-Size Img  PowerPoint
      Return
      Return