Search results for "Cooling"
showing 10 items of 470 documents
Daily patterns of mixing and nutrient concentrations during early autumn circulation in a small sheltered lake
2005
17 pages, 11 figures, 1 table.-- Printed version published May 2005.
Laser control of the radiationless decay in pyrazine using the dynamic Stark effect
2014
The laser control of the radiationless decay between the B(3u)(nπ*) and B(2u)(ππ*) states of pyrazine using the dynamic Stark effect has been investigated. A vibronic coupling model Hamiltonian in diabatic representation, including potential energy, transition dipole, and static polarizability surfaces as a function of the four most important vibrational modes of the molecule has been parametrized using multi-reference electronic structure calculations. The interaction of the molecule with a strong non-resonant laser pulse has been analyzed in terms of dressed potential energy surfaces. Because of the large polarizability difference between the vibronically coupled B(3u)(nπ*) and B(2u)(ππ*)…
Structural and conformational dynamics of supercooled polymer melts: Insights from first-principles theory and simulations
2007
We report on quantitative comparisons between simulation results of a bead-spring model and mode-coupling theory calculations for the structural and conformational dynamics of a supercooled, unentangled polymer melt. We find semiquantitative agreement between simulation and theory, except for processes that occur on intermediate length scales between the compressibility plateau and the amorphous halo of the static structure factor. Our results suggest that the onset of slow relaxation in a glass-forming melt can be described in terms of monomer-caging supplemented by chain connectivity. Furthermore, a unified atomistic description of glassy arrest and of conformational fluctuations that (as…
Communication: Protein dynamical transition vs. liquid-liquid phase transition in protein hydration water
2013
In this work, we compare experimental data on myoglobin hydrated powders from elastic neutron scattering, broadband dielectric spectroscopy, and differential scanning calorimetry. Our aim is to obtain new insights on the connection between the protein dynamical transition, a fundamental phenomenon observed in proteins whose physical origin is highly debated, and the liquid-liquid phase transition (LLPT) possibly occurring in protein hydration water and related to the existence of a low temperature critical point in supercooled water. Our results provide a consistent thermodynamic/dynamic description which gives experimental support to the LLPT hypothesis and further reveals how fundamental …
Molecular-dynamics simulation of a glassy polymer melt: Rouse model and cage effect
1999
We report results of molecular-dynamics simulations for a glassy polymer melt consisting of short, linear bead-spring chains. It was shown in previous work that this onset of the glassy slowing down is compatible with the predictions of the mode coupling theory. The physical process of `caging' of a monomer by its spatial neighbors leads to a distinct two step behavior in the particle mean square displacements. In this work we analyze the effects of this caging process on the Rouse description of the melt's dynamics. We show that the Rouse theory is applicable for length and time scales above the typical scales for the caging process. Futhermore, the monomer displacement is compared with si…
Non-isothermal crystallization kinetics of PET
2000
The crystallization kinetics of poly(ethylene terephthalate) was studied using constant cooling rate, isothermal and quenching experiments. A non-isothermal crystallization kinetics equation based on a single mechanism was used to analyze the data. Different mechanisms of crystallization at low, intermediate, and high cooling rates were hypothesized based on deviation of the experimental data from the single mechanism model.
Thermodynamic predictions of the formation of chalcogenide glasses
1985
The understanding of glass forming ability requires quantitative information on the stable and metastable phase equilibria of binary and multicomponent systems, particularly as a function of composition and temperature. This paper discusses the success of the use of Gibbs free energy curves for the supercooled liquid relative to the stable crystalline phases to describe glass forming ability. Applications are reported for the systems GeSe2-Se, Sb2Se3-Se and GeSe2-Sb2Se3 for which experimental minimal quenching rates are available. A strongly associated regular solution model for the liquid phase gives a predicted behaviour consistent with experimental data. The method is intended to apply t…
Structure development in poly(ethylene terephthalate) quenched from the melt at high cooling rates: X-ray scattering and microhardness study
2000
The structure and microhardness of poly(ethylene terephthalate) (PET) cooled from the melt, using a wide range of cooling rates, was studied. PET thin films rapidly cooled from the melt (cooling rates larger than 5°C/s) show a continuous variation of structure and properties depending on cooling rate. Results highlight differences in the micro-mechanical properties of the glass suggesting the occurrence of amorphous structures with different degrees of internal chain ordering. The comparative X-ray scattering study of two glassy PET samples (7500 and 17°C/s) reveals the occurrence of frozen-in electron density states giving rise to an excess of scattering for the amorphous sample solidified…
The X-ray determination of the amounts of the phases in samples of isotactic poly(propylene) quenched from the melt at different cooling rates
1997
A new procedure for the determination of the amounts of phases in samples of isotactic poly(propylene) quenched at different cooling rates from the same melted polymer is described. According to the procedure, all the patterns corresponding to the same quenching series are simultaneously analyzed for the amounts of phases so that reliable phase fractions relative to the different samples of the series are achieved. The analysis of the results points out that for increasing cooling rates above 30°C/s a remarkable increase of the mesomorphic phase settles, mainly at the expense of the α-monoclinic one.
Design, build-up and optimization of a fast quenching device for polymeric thin film
2014
In this work an innovative apparatus for the characterization of polymer solidification under very high cooling rates (up to thousand of K/s) is described, according to the continuous cooling transformation approach adopted in metallurgy for studying structure development in metals. The proposed model experiment is addressed to design a method for the characterization of non-isothermal solidification behaviour, encompassing typical cooling conditions of polymer processing. Only temperature history determines the structure formed, as melt solidification takes place in quiescent conditions. With respect to the device previously developed by the authors [1, 3] the present equipment presents th…