149 research outputs found
Tables of Overlap Integrals. II. Bonds between Some First Row and Second Row Atoms
Tables of overlap integrals for some bonds between the first
row atoms and the second row atoms are given. They are based on
atomic orbitals o,f Clementi and include the basic overlap integrals
of the valence shell orbitals only, i. e. overlaps between 2s anu 2p
orbitals of the first row atoms with 3s and 3p orbitals of tne second
row atoms. The intervals of interatomic distances are lim~ted so as
to cover known _variations in bond lengths reported in the, literature
Tables of Overlap Integrals. II. Bonds between Some First Row and Second Row Atoms
Tables of overlap integrals for some bonds between the first
row atoms and the second row atoms are given. They are based on
atomic orbitals o,f Clementi and include the basic overlap integrals
of the valence shell orbitals only, i. e. overlaps between 2s anu 2p
orbitals of the first row atoms with 3s and 3p orbitals of tne second
row atoms. The intervals of interatomic distances are lim~ted so as
to cover known _variations in bond lengths reported in the, literature
Tables of Overlap Integrals
Tables of overlap integrals for bonds between the first row
atoms and their hydrides are given. They are based on atomic
orbitals suggested by Clementi, which provide a more reliable
guide to the description of bonds than do Slater orbitals. The
region of interatomic distances is limited so as to cover known
bond lengths found in the literature
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