Band structure of molybdenum disulfide: from first principle to analytical band model

Band structure engineering of TiO2 from first-principles calculations

Broad Band Optical Properties of Large Area Monolayer CVD Molybdenum Disulfide

Wei Li,1,2 A. Glen Birdwell,3 Matin Amani,3 Robert A. Burke,3 Xi Ling,4 Yi-Hsien Lee,4,5 Xuelei Liang,2,* Lianmao Peng,2 Curt A. Richter,1 Jing Kong,4 David J. Gundlach,1 and N. V. Nguyen1,† 1Semiconductor and Dimensional Metrology Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899, USA 2Key Laboratory for the Physics and Chemistry of Nanodevices and Departme...

Quantification of Dopant Distribution and the Local Band Gap in Selenium-Doped Molybdenum Disulfide

1. Materials Science & Technology Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831, USA 2. Department of Chemistry, Rice University, Houston, TX 77005, USA 3. Department of Mechanical Engineering & Materials Science, Rice University, Houston, TX 77005, USA 4. School of Materials Science and Engineering, School of Electrical and Electronic Engineering Nanyang Technological University...

Electronic band structure of a Carbon nanotube superlattice

By employing the theoretical method based on tight-binding, we study electronic band structure of single-wall carbon nanotube (CNT) superlattices, which the system is the made of the junction between the zigzag and armchair carbon nanotubes. Exactly at the place of connection, it is appeared the pentagon–heptagon pairs as topological defect in carbon hexagonal network. The calculations are base...

Electronic band structure of a Carbon nanotube superlattice

By employing the theoretical method based on tight-binding, we study electronic band structure of single-wall carbon nanotube (CNT) superlattices, which the system is the made of the junction between the zigzag and armchair carbon nanotubes. Exactly at the place of connection, it is appeared the pentagon–heptagon pairs as topological defect in carbon hexagonal network. The calculations are base...