Spectroscopic Analysis of C20 Isomers by the U(2) Algebraic Model

被引:8
作者
Sen, Rupam [1 ]
Kalyan, Ashim [1 ]
Sarkar, Nirmal Kumar [2 ]
Bhattacharjee, Ramendu [3 ]
机构
[1] Srikishan Sarda Coll, Dept Phys, Hailakandi 788151, Assam, India
[2] Karimganj Coll, Dept Phys, Karimganj, India
[3] Assam Univ, Dept Phys, Silchar, India
关键词
Lie algebra; vibrational energy level; fullerene; PM3; model; ROTATION-VIBRATION SPECTRA; MOLECULES;
D O I
10.1080/1536383X.2011.629754
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The vibrational energy levels of C-20 isomers are calculated considering the local Hamiltonian of Morse potential using the U(2) Lie algebra. Here each bond of the molecule is replaced by a corresponding Lie algebra. Finally the local Hamiltonian is constructed considering the interacting Casimir and Majorana invariant operators. By constructing the Hamiltonian, we calculate the local mode vibrational energy levels of C-20 isomers and thus compare the accuracy of algebraic model with PM3 model.
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页码:403 / 410
页数:8
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