The tensor J8 contribution to the rotational energy of a tetrahedral molecule |
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Authors: | Irving Ozier |
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Institution: | Department of Physics, University of British Columbia, Vancouver, Canada |
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Abstract: | Two methods are outlined for calculating the tensor distortion energy of a tetrahedral molecule to the eighth degree in the rotational angular momentum. In the first, the entire distortion Hamiltonian including the eighth-rank distortion tensor is diagonalized. In the second, the basis which diagonalizes only the fourth rank tensor is used to generate tables which allow the direct determination of the octic energy terms. For J ≤ 20, numerical values are given of the diagonal matrix elements of and of the second-order perturbation correction due to offdiagonal matrix elements of the sixth-rank tensor . Explicit expressions in terms of angular momentum operators are given for and a selection of the operator equivalents T8,m. |
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