Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5382020 | Chemical Physics Letters | 2013 | 4 Pages |
Abstract
- Ab initio MD models of GeAsSe glasses starting from RMC structures.
- Bonding environment and Se-Se chain length trends mapped with changing mean coordination number (MCN).
- Deviation from the 8-N rule observed for individual elemental coordinations.
- Dependence of models on different starting structure investigated.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
G. Opletal, R.P. Wang, S.P. Russo,