Direct Dependence of Covalent, Van Der Waals, and Valence Shell Radii of Atoms on their Bohr Radii for the Main Group Elements
Raji Heyrovska
Institute of Biophysics, Academy of Sciences on the Czech Republic
Královopolská, Brno, Czech Republic
*corresponding author: This email address is being protected from spambots. You need JavaScript enabled to view it.
ABSTRACT
Recent work by the author has shown that ionic, atomic, and the ground state Bohr radii (aB) of elements are inter-related. An earlier work by others has shown that the ratio, van der Waals radii/de Broglie wavelengths is nearly constant for each group of some non-metallic elements. Since aB and the de Broglie wavelength are directly related, the author shows here that, in fact, for all the main group elements from 1A – 8A, the van der Waals radii are directly proportional to aB. It was found that the valence shell and covalent radii also vary linearly with aB. Thus, all the above radii (R) can be unified by a single linear equation, R = maB + c. Therefore, aB can be considered as a unit of length for the above radii as much as for the smaller Compton wavelength and classical radii (sum) of electron and proton.
INTRODUCTION
It was pointed out (Bondi 1964; Morrison 1955) over 40 years ago, with the available data then, that the ratio of the van der Waals radii (RvdW) of atoms to their de Broglie wavelengths (λdB) is nearly a constant for each group of non-metallic elements. The de Broglie wavelength (λdB = 2πaB) is related to the ground state Bohr radius (aB) and, aB, in turn, to ground state energy (or the ionization potential). Using existing data (Bondi 1964; Batsanov 2001; www.webelements.com), it was found that RvdW varies linearly with aB not only for the non-metallic elements, but also for all the elements from Group 1A to 8A. The straight lines have different slopes and non-zero intercepts (unlike in Bondi 1964; Morrison 1955). In Batsanov (2001), which has data for elements of groups 1A – 7A, two sets of data are given for the van der Waals radii, one from crystallographic data [which are comparable with the values given by Bondi (1964) and in www.webelements.com for elements of Groups 5A – 7A], and the other, denoted as equilibrium values, are for the isolated atoms. The latter are larger since the atoms have more free space than in the crystalline lattices. For elements of other groups, the graphs are not linear and are not considered here.
REFERENCES
BATSANOV SS. 2001. Vander Waals Radii of Elements. Inorg Mater 37: 871-885.
BONDI A. 1964. Vander Waals Radii of Elements. J Phys Chem 68: 441-451.
HEYROVSKA R. 2000. Aqueous redox potentials related to ionization potentials and electron affinities of elements by simple linear equations. 198th Meeting of the Electrochemical Society, USA, Phoenix, Arizona; 22-27 October 2000. Extended abstract No. 957. http:// www.electrochem.org/dl/ma/198/pdfs/0957.PDF
HEYROVSKA R. 2001. An estimation of the ionization potentials of actinides from a simple dependence of the aqueous standard potentials on the ionization potentials of elements including lanthanides. J Alloys and Compounds 323-324: 614-617.
HEYROVSKA R. 2005. The Golden ratio, ionic and atomic radii and bond lengths. Mol Phys 103: 877-882.
HEYROVSKA R. 2008. Linear Depenedences of Van Der Waals, Covalent and Valence Shell Radii of Atoms of Groups 1a - 8a on their Bohr Radii. http://www.arxiv. org/ftp/arxiv/papers/0708/0708.1108.pdf
LIEBMAN JF. 1973. Regularities and relations among ionization potentials of nontransition elements. J Chem Educ 50: 831-834.
MANN JB. 1968. Atomic Structure Calculations II. Hartree-Fock wave functions and radial expectation values: hydrogen to lawrencium, (LA-3691, Los Alamos Scientific Laboratory, USA). Reference from: http://www.webelements.com/carbon/orbital_ properties.html
MORRISON JD. 1955. Rev Pure Appl Chem 5: 46. (Ref. 9 in Bondi 1964.)
PAULING L. 1960. The Nature of the Chemical Bond. Ithaca, New York: Cornell Univ. Press. 644 p. http://www.webelements.com/carbon/orbital_properties. html, Copyright 1993-2008 Mark Winter [The University of Sheffield and WebElements Ltd, UK].