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Spectroscopy of XY5Z (C4v) Molecules: A Tensorial Formalism Adapted to the O(3) ⊃ Oh ⊃ C4v Chain

✍ Scribed by M. Rotger; V. Boudon; M. Loëte

Publisher
Elsevier Science
Year
2000
Tongue
English
Weight
115 KB
Volume
200
Category
Article
ISSN
0022-2852

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✦ Synopsis

A tensorial formalism adapted to the case of XY 5 Z symmetric tops has been developed as an extension of the usual one for the octahedral molecules. We use the O(3) ʛ O h ʛ C 4v group chain. All the coupling coefficients and formulas for the computation of matrix elements are given for this chain. Such relations are also deduced in the C 4v group itself.

📜 SIMILAR VOLUMES

Spectroscopy of XY5Z (C4v) Molecules: De
Spectroscopy of XY5Z (C4v) Molecules: Development of the Hamiltonian and the Transition Moment Operators Using a Tensorial Formalism
✍ M. Rotger; V. Boudon; M. Loëte 📂 Article 📅 2000 🏛 Elsevier Science 🌐 English ⚖ 110 KB

We present a development of the Hamiltonian, dipole moment, and polarizability operators of XY 5 Z (C 4v ) molecules using a tensorial formalism derived from the one developed previously in Dijon for XY 6 molecules. These operators are involved in the calculation of the energies and intensities of r

Spectroscopy of XY2Z2 (C2v) Molecules: A
Spectroscopy of XY2Z2 (C2v) Molecules: A Tensorial Formalism Adapted to the O(3)⊃Td⊃C2v Chain. Application to the Ground State of SO2F2
✍ M Rotger; V Boudon; M Loëte 📂 Article 📅 2002 🏛 Elsevier Science 🌐 English ⚖ 290 KB

A tensorial formalism adapted to the case of quasi-spherical XY 2 Z 2 asymmetric tops such as SO 2 F 2 has been developed as an extension of the usual one for the tetrahedral molecules. We use the O(3) ⊃ T d ⊃ C 2v group chain. All the coupling coefficients and formulas for the computation of matrix