✦ LIBER ✦

Density functional study of the metallization of a linear carbon chain inside single wall carbon nanotubes

✍ Scribed by A. Tapia; L. Aguilera; C. Cab; R.A. Medina-Esquivel; R. de Coss; G. Canto

Publisher: Elsevier Science
Year: 2010
Tongue: English
Weight: 841 KB
Volume: 48
Category: Article
ISSN: 0008-6223
DOI: 10.1016/j.carbon.2010.07.011

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Computer simulation of argon cluster ins

Computer simulation of argon cluster inside a single-walled carbon nanotube

✍ M Kośmider; Z Dendzik; S Pałucha; Z Gburski 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 307 KB

Properties of single-walled carbon nanot

Properties of single-walled carbon nanotube-based aerogels as a function of nanotube loading

✍ Marcus A. Worsley; Peter J. Pauzauskie; Sergei O. Kucheyev; Joseph M. Zaug; Alex 📂 Article 📅 2009 🏛 Elsevier Science 🌐 English ⚖ 433 KB

Here, we present the synthesis and characterization of low-density single-walled carbon nanotube-based aerogels (SWNT-CA). Aerogels with varying nanotube loading (0-55 wt.%) and density (20-350 mg cm À3 ) were fabricated and characterized by four-probe method, electron microscopy, Raman spectroscopy

Energetics and electronic structure of a

Energetics and electronic structure of acetylene molecules encapsulated inside a carbon nanotube: A density functional theory study

✍ E. Martínez-Guerra; G. Canto; Noboru Takeuchi 📂 Article 📅 2006 🏛 Elsevier Science 🌐 English ⚖ 117 KB

Engineering the Electronic Structure of

Engineering the Electronic Structure of Single-Walled Carbon Nanotubes by Chemical Functionalization

✍ Jijun Zhao; Zhongfang Chen; Zhen Zhou; Hyoungki Park; Paul von Ragué Schleyer; J 📂 Article 📅 2005 🏛 John Wiley and Sons 🌐 English ⚖ 123 KB 👁 1 views

A continuum model for calculating the ph

A continuum model for calculating the phonon density of states of single-walled carbon nanotubes

✍ Minggang Xia; Shengli Zhang; Shumin Zhao; Erhu Zhang 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 247 KB

Making use of the continuum model, the phonon density of states (PDOS) are calculated analytically for singlewalled carbon nanotubes (SWNT). Neglecting the interaction between twisting and longitudinal stress, the phonon dispersion relations are also determined analytically. The frequency of the bre

Ab initio density functional theory inve

Ab initio density functional theory investigation of electronic properties of semiconducting single-walled carbon nanotube bundles

✍ Rostam Moradian; Somayeh Behzad; Sam Azadi 📂 Article 📅 2008 🏛 Elsevier Science 🌐 English ⚖ 340 KB