Vibrational Spectra on the Double Minimum Potenial of Deoxyheme Due to the Pseudo-Jahn-Teller Interaction

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概要

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• The vibrational energy levels and wave functions of deoxyheme are obtainedby the perturbation method based on the double minimum potential due to thepseudo-Jahn-Teller distortion of out-of-plane A.. speci<ps. These vibrationalenergy levels are almost doubly degenerate. Among the infrared-active modes, thefrequencies of the pseudo-Jahn-Teller active three modes 212. and E. are ex-pected to be smaller than those calculated by Warshel and LappicireJ1a. Theasymmetric position of ./V, in the imidazole produces the asymmetric and rhombicfield around the iron. The adjustment of the adiabatic potentials of Loew andKirchner to those including the pseudo-Jahn-Teller interaction gives somewhatunreasonable values of the potential depths and frequencies.

• 社団法人日本物理学会の論文
• 1984-09-15

著者

• Mizuhashi Seiji

  Physics Department The University Of Electro-communications

関連論文

• Vibronic Coupling in Normal Human Deoxyhemoglobin (Hb-A)
• Parity-Forbidden Transitions of Deoxyheme
• Partial Quenching of Off-Diagonal Racah Parameters and Diminishing of Diagonal Elements Due to Dynamical Jahn-Teller Effect T_1(d^N) and T_2(d^N)×ε
• Vibrational Spectra on the Double Minimum Potenial of Deoxyheme Due to the Pseudo-Jahn-Teller Interaction

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