Band structure of polyacetylene, (CH)x

作者: P.M. Grant , I.P. Batra

DOI: 10.1016/0038-1098(79)91043-3

关键词: Condensed matter physicsElectronic band structurePolyacetyleneChemical physicsChemistryDopingPolymer

摘要: The one-electron energy bands and densities of states polyacetylene in both cis- trans-conformations have been investigated. principal issue addressed is whether the itinerant picture alone sufficient to explain experimental properties this material. We conclude that model provides an excellent zeroth-order explanation current observations optical transport effects pure doped forms unusual polymer.

参考文章(21)
Hideki Shirakawa, Takeo Ito, Sakuji Ikeda, Raman Scattering and Electronic Spectra of Poly(acetylene) Polymer Journal. ,vol. 4, pp. 460- 462 ,(1973) , 10.1295/POLYMJ.4.460
C. K. Chiang, M. A. Druy, S. C. Gau, A. J. Heeger, E. J. Louis, A. G. MacDiarmid, Y. W. Park, H. Shirakawa, Synthesis of highly conducting films of derivatives of polyacetylene, (CH)x Journal of the American Chemical Society. ,vol. 100, pp. 1013- 1015 ,(1978) , 10.1021/JA00471A081
A A Ovchinnikov, I I Ukrainskiĭ, G V Kventsel', THEORY OF ONE-DIMENSIONAL MOTT SEMICONDUCTORS AND THE ELECTRONIC STRUCTURE OF LONG MOLECULES HAVING CONJUGATED BONDS Physics-Uspekhi. ,vol. 15, pp. 575- 591 ,(1973) , 10.1070/PU1973V015N05ABEH005011
Mikio Tsuji, Sigeru Huzinaga, Tasuke Hasino, Bond Alternation in Long Polyenes Reviews of Modern Physics. ,vol. 32, pp. 425- 427 ,(1960) , 10.1103/REVMODPHYS.32.425
C. K. Chiang, C. R. Fincher, Y. W. Park, A. J. Heeger, H. Shirakawa, E. J. Louis, S. C. Gau, Alan G. MacDiarmid, Electrical Conductivity in Doped Polyacetylene. Physical Review Letters. ,vol. 39, pp. 1098- 1101 ,(1977) , 10.1103/PHYSREVLETT.39.1098
C.K. Chiang, M.J. Cohen, A.F. Garito, A.J. Heeger, C.M. Mikulski, A.G. MacDiarmid, Electrical conductivity of (SN)x Solid State Communications. ,vol. 18, pp. 1451- 1455 ,(1976) , 10.1016/0038-1098(76)90367-7
Robert A. Harris, L. M. Falicov, Self‐Consistent Theory of Bond Alternation in Polyenes: Normal State, Charge‐Density Waves, and Spin‐Density Waves The Journal of Chemical Physics. ,vol. 51, pp. 5034- 5041 ,(1969) , 10.1063/1.1671900
R. L. Greene, P. M. Grant, G. B. Street, Low-Temperature Specific Heat of Polysulfur Nitride, (SN) x Physical Review Letters. ,vol. 34, pp. 89- 92 ,(1975) , 10.1103/PHYSREVLETT.34.89
R. L. Greene, G. B. Street, L. J. Suter, Superconductivity in Polysulfur Nitride ( SN ) X Physical Review Letters. ,vol. 34, pp. 577- 579 ,(1975) , 10.1103/PHYSREVLETT.34.577
W.L. McCubbin, An assessment of polymer band structure calculations Chemical Physics Letters. ,vol. 8, pp. 507- 512 ,(1971) , 10.1016/0009-2614(71)80079-9