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Information Journal Paper

Title

A SIMPLE METHOD FOR DERIVATION OF THE ROVIBRATIONAL HAMILTONIAN: APPLICATION TO ORTHOGONAL RADAU COORDINATE SYSTEMS AS SPECIAL CASES

Pages

  77-83

Abstract

 The molecular Hamiltonian of polyatomic molecules has been obtained. A general choice of internal coordinates depending on external parameters was considered. The ROVIBRATIONAL HAMILTONIAN for this set of coordinate system was derived in general terms as a function of the external parameters a and b. This procedure is also applicable to various kinds of internal coordinates in a straightforward way. The ROVIBRATIONAL HAMILTONIAN of triatomic molecules is considered as an APPLICATION of this general formulation. In addition, orthogonal Radau coordinates are considered as cases of this new approach.

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    • Cite

    APA: Copy

    EBRAHIMI, H.P., TAFAZOLI, M., & ESLAMPOUR, R.. (2010). A SIMPLE METHOD FOR DERIVATION OF THE ROVIBRATIONAL HAMILTONIAN: APPLICATION TO ORTHOGONAL RADAU COORDINATE SYSTEMS AS SPECIAL CASES. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), 7(1), 77-83. SID. https://sid.ir/paper/282426/en

    Vancouver: Copy

    EBRAHIMI H.P., TAFAZOLI M., ESLAMPOUR R.. A SIMPLE METHOD FOR DERIVATION OF THE ROVIBRATIONAL HAMILTONIAN: APPLICATION TO ORTHOGONAL RADAU COORDINATE SYSTEMS AS SPECIAL CASES. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS)[Internet]. 2010;7(1):77-83. Available from: https://sid.ir/paper/282426/en

    IEEE: Copy

    H.P. EBRAHIMI, M. TAFAZOLI, and R. ESLAMPOUR, “A SIMPLE METHOD FOR DERIVATION OF THE ROVIBRATIONAL HAMILTONIAN: APPLICATION TO ORTHOGONAL RADAU COORDINATE SYSTEMS AS SPECIAL CASES,” JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), vol. 7, no. 1, pp. 77–83, 2010, [Online]. Available: https://sid.ir/paper/282426/en

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