Optical phonons for Peierls chains with long-range Coulomb interactions

被引:3
作者
Timar, Mate [1 ,2 ]
Barcza, Gergely [1 ]
Gebhard, Florian [3 ]
Legeza, Oers [1 ]
机构
[1] MTA Wigner Res Ctr Phys, Inst Solid State Phys & Opt, Strongly Correlated Syst Lendulet Res Grp, POB 49, H-1525 Budapest, Hungary
[2] Eotvos Lorand Univ, Dept Phys Complex Syst, H-1117 Budapest, Hungary
[3] Philipps Univ Marburg, Fachbereich Phys, D-35032 Marburg, Germany
关键词
RAMAN-SCATTERING; DENSITY;
D O I
10.1103/PhysRevB.95.085150
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We consider a chain of atoms that are bound together by a harmonic force. Spin-1/2 electrons that move between neighboring chain sites (Huckel model) induce a lattice dimerization at half band filling (Peierls effect). We supplement the Huckel model with a local Hubbard interaction and a long-range Ohno potential, and calculate the average bond-length, dimerization, and optical phonon frequencies for finite straight and zigzag chains using the density-matrix renormalization group (DMRG) method. We check our numerical approach against analytic results for the Huckel model. The Hubbard interaction mildly affects the average bond length but substantially enhances the dimerization and increases the optical phonon frequencies whereas, for moderate Coulomb parameters, the long-range Ohno interaction plays no role.
引用
收藏
页数:15
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