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Self-consistent electronic band structures of extended polydiacetylene chains with realistic model side groups

✍ Scribed by D.E. Parry


Publisher
Elsevier Science
Year
1977
Tongue
English
Weight
319 KB
Volume
46
Category
Article
ISSN
0009-2614

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✦ Synopsis


Reccivcd I5 Dcccmbcr 1976 Scil-consistent xxn~rmpirnxl band C1ructurc caicuiJtlon\ For lroidtcd extcndcd poiydixetyiene chains airh a v.lricty of rcahstlc modci Fide groups hdvc been pcrformcd. I or side groups with a CH2 group nelt to 111c CII.UI bockbone tbc prcd~ctcd bdnd gip A = 0.5 CV 15 sub\t.mtrJiy mdcpcndznr of the dctalcd structure of the cdc group .md much smaiiur th.ln the optx~d db\orption thrcshoids c\pcrlmcntniiy obccrv~xl_ rhcsc rcsuits support the hypothesis th,lt the icw cncrgy ciectronic cxat.lfions or thc\c systcrils Jr': hcttcr dcscrdxtl by dn cxcltomc, rather 111.m .m clcctronic.

bmtl model.