scholarly journals Lattice induced crystallization of nanodroplets: the role of finite-size effects and substrate properties in controlling polymorphism

Nanoscale ◽  
2018 ◽  
Vol 10 (10) ◽  
pp. 4921-4926 ◽  
Author(s):  
Julien Lam ◽  
James F. Lutsko
Keyword(s):  
Molecular Dynamics ◽  
Size Effects ◽  
Finite Size ◽  
Solid Substrate ◽  
General Phenomenon ◽  
Finite Size Effects ◽  
Substrate Properties ◽  
Dynamics Simulations ◽  
Induced Crystallization

Freezing a nanodroplet deposited on a solid substrate leads to the formation of crystalline structures. We study the inherent mechanisms underlying this general phenomenon by means of molecular dynamics simulations.

Finite-size effects on the lattice dynamics in spin crossover nanomaterials. II. Molecular dynamics simulations

2017 ◽  
Vol 96 (3) ◽  
Author(s):  
Mirko Mikolasek ◽  
William Nicolazzi ◽  
Férial Terki ◽  
Gábor Molnár ◽  
Azzedine Bousseksou
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Size Effects ◽  
Lattice Dynamics ◽  
Spin Crossover ◽  
Finite Size ◽  
Finite Size Effects ◽  
Dynamics Simulations
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