Mapping ground-state properties of silicon carbide molecular clusters using quantum mechanical calculations: Si_mC_n and Si_m C_n^- (m, n ⩽ 4)

Authors

Xiaofeng F. Duan, Air Force Institute of Technology
Jean Wei, Air Force Institute of Technology
Larry W. Burggraf, Air Force Institute of TechnologyFollow
David E. Weeks, Air Force Institute of TechnologyFollow

Document Type

Article

Publication Date

1-2010

Comments

Co-author J. Wei was enrolled in an AFIT PhD program at the time of this article. (AFIT-DS-ENP-11-M02, March 2011)

Plain-text title form: Mapping ground-state properties of silicon carbide molecular clusters using quantum mechanical calculations: SimCn and Sim Cn- (m, n ≤ 4)

DOI

10.1016/j.commatsci.2009.09.006

Source Publication

Computational Materials Science (ISSN 0927-0256 | eISSN 1879-0801)

Recommended Citation

Duan, X., Wei, J., Burggraf, L., & Weeks, D. (2010). Mapping ground-state properties of silicon carbide molecular clusters using quantum mechanical calculations: SimCn and (M,n⩽4). Computational Materials Science, 47(3), 630–644. https://doi.org/10.1016/j.commatsci.2009.09.006