Bonding and short-range order in liquid silicon-carbon alloys
Journal
Physical Review B
Date Issued
1991
Author(s)
DOI
10.1103/PhysRevB.44.5336
Abstract
Simulations of liquid silicon-carbon mixtures show that, at low pressures, the tendency of carbon towards low coordination dominates the overall structural characteristics. As a result silicon coordination is lower than in pure l-Si, accompanied by an enhancement of tetrahedral order and covalent bonding which persist in the liquid. The distribution of atoms is random in contrast to amorphous Si-C alloys. Under high pressures (1 Mbar) carbon coordination remains lower than four. At this pressure pure l-C is less dense than diamond.
Subjects