Density functional calculations for C60 peapods

• Published in: Physical review. B, Condensed matter and materials physics Vol. 70; no. 16; p. 165424.1
• Main Authors: DUBAY, O, KRESSE, G
• Format: Journal Article
• Language: English
• Published: Ridge, NY American Physical Society 2004
• Subjects: Condensed matter: electronic structure, electrical, magnetic, and optical properties; Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures; Electronic structure of nanoscale materials : clusters, nanoparticles, nanotubes, and nanocrystals; Exact sciences and technology; Physics; Band structure; Electronic structure; Semiconductor materials; Electron affinity; Binding energy; Nanotubes; Fullerenes; Density functional method; Hybridization; Electronic density of states; Local density approximation
• ISSN: 1098-0121; 1550-235X