Topological Study of the Periodic System

We carried out a topological study of the Space of Chemical Elements, SCE, based on a clustering analysis of 72 elements, each one defined by a vector of 31 properties. We looked for neighborhoods, boundaries, and other topological properties of the SCE. Among the results one sees the well-known patterns of the Periodic Table and relationships such as the Singularity Principle and the Diagonal Relationship, but there appears also a robustness property of some of the better-known families of elements. Alkaline metals and Noble Gases are sets whose neighborhoods have no other elements besides themselves, whereas the topological boundary of the set of metals is formed by semimetallic elements.

[1]  John M. Barnard,et al.  Chemical Similarity Searching , 1998, J. Chem. Inf. Comput. Sci..

[2]  David Robert,et al.  On the extension of quantum similarity to atomic nuclei: Nuclear quantum similarity , 1998 .

[3]  Vladik Kreinovich,et al.  Ordinal Explanation of the Periodic System of Chemical Elements , 1998, Int. J. Uncertain. Fuzziness Knowl. Based Syst..

[4]  Daniel R. Lewin,et al.  Automated Nonlinear Model Predictive Control using Genetic Programming , 2002 .

[5]  Douglas J. Klein,et al.  Partial Orderings in Chemistry , 1997, J. Chem. Inf. Comput. Sci..

[6]  M. Laing Melting Point, Density, and Reactivity of Metals , 2001 .

[7]  Nathan M. Brooks Developing the Periodic Law: Mendeleev's Work During 1869–1871 , 2002 .

[8]  P. Sneath Numerical Classification of the Chemical Elements and Its Relation to the Periodic System , 2000 .

[9]  C. Singman,et al.  Atomic volume and allotropy of the elements , 1984 .

[10]  Douglas J. Klein,et al.  Similarity and dissimilarity in posets , 1995 .

[11]  R. Carbó-Dorca,et al.  General trends in atomic and nuclear quantum similarity measures , 2000 .

[12]  Roberto Tonelli,et al.  Chua's Periodic Table , 2002, Int. J. Bifurc. Chaos.

[13]  Mendeléeff LXIII.—The Periodic Law of the Chemical Elements , 1889 .

[14]  T. Négadi On the planar periodic table , 2000 .

[15]  Eric R. Scerri Has the Periodic Table Been Successfully Axiomatized? , 1997 .

[16]  A. H. Lipkus A proof of the triangle inequality for the Tanimoto distance , 1999 .

[17]  Fred R. McMorris,et al.  Consensusn-trees , 1981 .