形变小直径扶手椅型碳纳米管的电子性质.pdfVIP

第30卷第1期 南 京 工 业 大 学 学 报 (自然科学版) Vo1．30 No．1 nce Ed Jan．2008 2008年1月 JOURNAL OF NANJING UNIVERSITY OF TECHNOLOGY(Natural Scie ition) — — 形变小直径扶手椅型碳纳米管的电子性质 韩 梅，张 勇，黄礼胜 (南京工业大学理学院，江苏 南京210009) 摘 要：在紧束缚近似下，解析地推导了轴向拉伸和扭转形变下小直径单壁碳纳米管(SWNT)的能量色散关系．分 析了拉伸和扭转形变对小直径扶手椅型SWNT的电子性质的影响．结果表明，在拉伸形变下扶手椅型SWNT仍然 是导体，但其费米速度随拉伸比的变大而变大；在拉伸比不变的情况下，考虑曲率效应后其费米速度变大．在扭转 形变下，扶手椅型SWNT变成了半导体，其能隙随扭转度的变大而变大；在扭转度不变的情况下，考虑曲率效应后 能隙变化不大． 关键词：扶手椅型SWNT；曲率效应；费米速度；能隙 中图分类号：O481 文献标识码：A 文章编号：1671—7627(2008)0l一0019—04 Electron properties of deformed armchair single—walled carbon nanotubes with small diameter HAN Mei，ZHANG Yong，HUANG Li—sheng (College of Sciences，Nanjing University of Technology，Nanjing 210009，China) Abstract：By tight—binding approximation，the energy dispersion of small diameter single—walled carbon nanotubes (SWNT)under tensile and torsional strains has been derived．The effect of tensile and torsional strains on electron— ic properties of small diameter armchair SWNT has been discussed．It was found that，under tensile strain，the armchair SWNT still was metallic，but the Fermi velocities of them increased with increasing tensile strain．Consid— ering the curvature effect，the Fermi velocity was larger than that of without curvature effect at the fixing tensile strains．Under torsional strains，the armchair SWNT was semiconductors．The energy gap increased with increasing torsional strains，while the energy gap of the armch