January 16 2003
Average configurations for 1409 atoms
At each temperature level, the positions of atoms were averaged over one
hundred configurations. All calculations were taken on the average
configuration at each temperature.
Flatness and bond curvature
99K |
|
|
200K |
|
|
293K |
|
|
403K |
|
|
508K |
|
|
603K |
|
|
706K |
|
|
807K |
|
|
966K |
|
|
Local curvatures
99K
200K
293K
403K
508K
603K
706K
807K
966K