Timothy J. Lee, Charles W. Bauschlicher Jr., et al.
Chemical Physics Letters
A series of CAS SCF calculations are used to describe the lowest states of TiO. TiO is described as having polarized double bonds involving the Ti 3d orbitals. The nature of the excited states is discussed. © 1983.
Timothy J. Lee, Charles W. Bauschlicher Jr., et al.
Chemical Physics Letters
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The Journal of Chemical Physics
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