Molecular-dynamics study of structural-phase transitions. I. One-component displacement models

1976 ◽  
Vol 13 (3) ◽  
pp. 1216-1237 ◽  
Author(s):  
T. Schneider ◽  
E. Stoll
Keyword(s):  
Molecular Dynamics ◽  
Phase Transitions ◽  
Structural Phase ◽  
Structural Phase Transitions ◽  
Component Displacement

Insight into the molecular dynamics of guest cations confined in deformable azido coordination frameworks

2015 ◽  
Vol 51 (86) ◽  
pp. 15641-15644 ◽  
Author(s):  
Zi-Yi Du ◽  
Yu-Zhi Sun ◽  
Shao-Li Chen ◽  
Bo Huang ◽  
Yu-Jun Su ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Phase Transitions ◽  
Structural Phase ◽  
Structural Phase Transitions ◽  
Insight Into ◽  
Coordination Frameworks

The guest molecular dynamics confined in deformable azido coordination frameworks are revealed, one of which features unvaried/varied Ea during its two structural phase transitions.

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