A theoretical investigation of electronic and optical properties of (6,1) single-wall carbon nanotub...
A theoretical investigation of electronic and optical properties of (6,1) single-wall carbon nanotube (SWCNT)
About this item
Full title
Author / Creator
Rai, D. P. , Singh, Y. T. , Chettri, B. , Houmad, M. and Patra, P. K.
Publisher
Singapore: Springer Singapore
Journal title
Language
English
Formats
Publication information
Publisher
Singapore: Springer Singapore
Subjects
More information
Scope and Contents
Contents
We report the comparative study of electronic and optical properties of (6,1) SWCNT from GGA and DFT-1/2 methods. (6,1) SWCNT is a low-bandgap semiconductor, which falls within (
n
1
-
n
2
)/3
≠
integer. The calculated bandgaps are 0.371 eV and 0.462 eV from GGA and DFT-1/2, respectively. Thus, DFT-1/2 enhanced the electroni...
Alternative Titles
Full title
A theoretical investigation of electronic and optical properties of (6,1) single-wall carbon nanotube (SWCNT)
Authors, Artists and Contributors
Author / Creator
Identifiers
Primary Identifiers
Record Identifier
TN_cdi_nrf_kci_oai_kci_go_kr_ARTI_9976917
Permalink
https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_nrf_kci_oai_kci_go_kr_ARTI_9976917
Other Identifiers
ISSN
1976-4251
E-ISSN
2233-4998
DOI
10.1007/s42823-020-00172-8
