Thermal and vibrational investigation of crystal nucleation and growth from a physically confined and supercooled liquid

1996 ◽  
Vol 53 (10) ◽  
pp. 6041-6047 ◽  
Author(s):  
R. Mu ◽  
Y. Xue ◽  
D. O. Henderson ◽  
D. O. Frazier
Keyword(s):  
Supercooled Liquid ◽  
Nucleation And Growth ◽  
Crystal Nucleation

A Vibrational Investigation of Crystal Nucleation and Growth from a Physically Confined and Supercooled Liquid

1994 ◽  
Vol 366 ◽  
Author(s):  
R. Mu ◽  
D. O. Henderson ◽  
Z. Pan ◽  
Y. Xue
Keyword(s):  
Solid Phase ◽  
Porous Silica ◽  
Supercooled Liquid ◽  
Nucleation And Growth ◽  
Crystal Nucleation ◽  
Melting Transition ◽  
Temperature Dependent ◽  
Freezing Transition ◽  
20 Nm

ABSTRACTTemperature dependent Raman measurements were conducted on bulk and the confined 2,4,6-trinitrotoluene (TNT) in 2.5, 5, 10, and 20 nm porous silica. Two bands at 23 and 190 cm−1 were chosen to evaluate the structure and the melting and freezing transitions of the confined TNT in pores. The results show that the solid phase TNT confined in larger pores (dp > 5 nm) forms conventional solid TNT structure, while the TNT restricted in small pores has no freezing and melting transition characteristics. The results also suggest that the freezing transition of the confined TNT starts at the pore center and the confined TNT maintains its interconnectivity during the freezing transition.

scholarly journals Molecular Dynamics Simulations of Crystal Nucleation near Interfaces in Incompatible Polymer Blends

Polymers ◽  
2021 ◽  
Vol 13 (3) ◽  
pp. 347
Author(s):  
Wenlin Zhang ◽  
Lingyi Zou
Keyword(s):  
Molecular Dynamics ◽  
Polymer Blends ◽  
Md Simulations ◽  
Nucleation And Growth ◽  
Crystal Nucleation ◽  
Crystalline Order ◽  
Mobile Species ◽  
Deep Supercooling ◽  
Crystallizable Polymer ◽  
Dynamics Simulations

We apply molecular dynamics (MD) simulations to investigate crystal nucleation in incompatible polymer blends under deep supercooling conditions. Simulations of isothermal nucleation are performed for phase-separated blends with different degrees of incompatibility. In weakly segregated blends, slow and incompatible chains in crystallizable polymer domains can significantly hinder the crystal nucleation and growth. When a crystallizable polymer is blended with a more mobile species in interfacial regions, enhanced molecular mobility leads to the fast growth of crystalline order. However, the incubation time remains the same as that in pure samples. By inducing anisotropic alignment near the interfaces of strongly segregated blends, phase separation also promotes crystalline order to grow near interfaces between different polymer domains.

scholarly journals Crystal nucleation and growth kinetics of NaF in photo-thermo-refractive glass

2013 ◽  
Vol 378 ◽  
pp. 115-120 ◽  
Author(s):  
I. Dyamant ◽  
A.S. Abyzov ◽  
V.M. Fokin ◽  
E.D. Zanotto ◽  
J. Lumeau ◽  
...  
Keyword(s):  
Growth Kinetics ◽  
Nucleation And Growth ◽  
Crystal Nucleation ◽  
Kinetics Of

Membrane-protein crystals for neutron diffraction

2018 ◽  
Vol 74 (12) ◽  
pp. 1208-1218 ◽  
Author(s):  
Thomas Lykke-Møller Sørensen ◽  
Samuel John Hjorth-Jensen ◽  
Esko Oksanen ◽  
Jacob Lauwring Andersen ◽  
Claus Olesen ◽  
...  
Keyword(s):  
Membrane Proteins ◽  
Neutron Diffraction ◽  
Membrane Protein ◽  
Neutron Source ◽  
Nucleation And Growth ◽  
Crystal Nucleation ◽  
Protein Crystals ◽  
Macromolecular Crystallography ◽  
Transport Mechanisms ◽  
Potential Impact

Neutron macromolecular crystallography (NMX) has the potential to provide the experimental input to address unresolved aspects of transport mechanisms and protonation in membrane proteins. However, despite this clear scientific motivation, the practical challenges of obtaining crystals that are large enough to make NMX feasible have so far been prohibitive. Here, the potential impact on feasibility of a more powerful neutron source is reviewed and a strategy for obtaining larger crystals is formulated, exemplified by the calcium-transporting ATPase SERCA1. The challenges encountered at the various steps in the process from crystal nucleation and growth to crystal mounting are explored, and it is demonstrated that NMX-compatible membrane-protein crystals can indeed be obtained.

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