Room temperature peierls distortion in small diameter nanotubes.

نویسندگان

  • D Connétable
  • G-M Rignanese
  • J-C Charlier
  • X Blase
چکیده

By means of ab initio simulations, we investigate the phonon band structure and electron-phonon coupling in small 4-A diameter nanotubes. We show that both the C(5,0) and C(3,3) tubes undergo above room temperature a Peierls transition mediated by an acoustical long wavelength and an optical q=2k(F) phonon, respectively. In the armchair geometry, we verify that the electron-phonon coupling parameter lambda originates mainly from phonons at q=2k(F) and is strongly enhanced when the diameter decreases. These results question the origin of superconductivity in small diameter nanotubes.

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Lattice dynamics and electron-phonon interaction in (3,3) carbon nanotubes.

We present a detailed study of the lattice dynamics and electron-phonon coupling for a (3,3) carbon nanotube which belongs to the class of small diameter based nanotubes which have recently been claimed to be superconducting. We treat the electronic and phononic degrees of freedom completely by modern ab initio methods without involving approximations beyond the local density approximation. Usi...

متن کامل

Excitons and Peierls distortion in conjugated carbon nanotubes.

We investigate coupled excitonic and vibrational effects in carbon nanotubes using a time-dependent Hartree-Fock approach. The results reveal intricate details of excited-state dynamics. In the ground state, spontaneous uneven distribution of the pi electrons over the bonds (i.e., Peierls dimerization) is observed throughout the entire nanotube, particularly in large-radius CNTs. However, we de...

متن کامل

Optical phonons in carbon nanotubes: Kohn anomalies, Peierls distortions, and dynamic effects

We present a detailed study of the vibrational properties of single wall carbon nanotubes SWNTs . The phonon dispersions of SWNTs are strongly shaped by the effects of electron-phonon coupling. We analyze the separate contributions of curvature and confinement. Confinement plays a major role in modifying SWNT phonons and is often more relevant than curvature. Due to their one-dimensional charac...

متن کامل

Diameter-selective dispersion of single-walled carbon nanotubes using a water-soluble, biocompatible polymer.

One-step diameter-selective dispersion of HiPco single-walled carbon nanotubes has been accomplished through noncovalent complexation of the nanotubes with a water-soluble, biocompatible polymer chitosan at room temperature.

متن کامل

Recent advances in the internal functionalization of carbon nanotubes: synthesis, optical, and magnetic resonance studies

The hollow inside of single-wall carbon nanotubes (SWCNT) provides a unique degree of freedom to investigate chemical reactions inside this confined environment and to study the tube properties. It is reviewed herein, how encapsulating fullerenes, magnetic fullerenes, C isotope enriched fullerenes and organic solvents inside SWCNTs enables to yield unprecedented insight into their electronic, o...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

عنوان ژورنال:
  • Physical review letters

دوره 94 1  شماره 

صفحات  -

تاریخ انتشار 2005