The discussion of molecular orbitals and equivalent orbitals, given in previous papers, is carried a stage further. It is shown that certain molecular properties can be evaluated using either ...
This is a preview. Log in through your library . Abstract When the molecular orbital wave function is taken as a single determinant it is not possible to construct localized orbitals for the mobile ...
Some results have been hidden because they may be inaccessible to you
Show inaccessible results