Search results for "Diffusion"
showing 10 items of 1615 documents
Short photoluminescence lifetimes in vacuum-deposited ch3nh3pbI3 perovskite thin films as a result of fast diffusion of photogenerated charge carriers
2019
It is widely accepted that a long photoluminescence (PL) lifetime in metal halide perovskite films is a crucial and favorable factor, as it ensures a large charge diffusion length leading to a high power conversion efficiency (PCE) in solar cells. It has been recently found that vacuumevaporated CH3NH3PbI3 (eMAPI) films show very short PL lifetimes of several nanoseconds. The corresponding solar cells, however, have high photovoltage (>1.1 V) and PCEs (up to 20%). We rationalize this apparent contradiction and show that eMAPI films are characterized by a very high diffusion coefficient D, estimated from modeling the PL kinetics to exceed 1 cm2/s. Such high D values are favorable for long di…
INTERPRETATION OF POTENTIAL INTERMITTENCE TITRATION TECHNIQUE EXPERIMENTS FOR VARIOUS Li-INTERCALATION ELECTRODES
2002
In this paper we compare two different approaches for the calculation of the enhancement factor Wi , based on its definition as the ratio of the chemical and the component diffusion coefficients for species in mixed-conduction electrodes, originated from the “dilute solution” or “lattice gas” models for the ion system. The former approach is only applicable for small changes of the ion concentration while the latter allows one to consider a broad range of intercalation levels. The component diffusion coefficient of lithium ions has been determined for a series of lithium intercalation anodes and cathodes. A new “enhancement factor” for the ion transport has been defined and its relations to…
Blistering mechanisms of atomic-layer-deposited AlN and Al2O3 films
2017
Blistering of protective, structural, and functional coatings is a reliability risk pestering films ranging from elemental to ceramic ones. The driving force behind blistering comes from either excess hydrogen at the film-substrate interface or stress-driven buckling. Contrary to the stress-driven mechanism, the hydrogen-initiated one is poorly understood. Recently, it was shown that in the bulk Al-Al2O3 system, the blistering is preceded by the formation of nano-sized cavities on the substrate. The stress-and hydrogen-driven mechanisms in atomic-layer-deposited (ALD) films are explored here. We clarify issues in the hydrogen-related mechanism via high-resolution microscopy and show that at…
Coupling of Nanoparticle Dynamics to Polymer Center-of-Mass Motion in Semidilute Polymer Solutions
2017
We investigate the dynamics of nanoparticles in semidilute polymer solutions when the nanoparticles are comparably sized to the polymer coils using explicit- and implicit-solvent simulation methods. The nanoparticle dynamics are subdiffusive on short time scales before transitioning to diffusive motion on long time scales. The long-time diffusivities scale according to theoretical predictions based on full dynamic coupling to the polymer segmental relaxations. In agreement with our recent experiments, however, we observe that the nanoparticle subdiffusive exponents are significantly larger than predicted by the coupling theory over a broad range of polymer concentrations. We attribute this …
Structure–property relationship and controlled drug release from multiphasic electrospun carvacrol-embedded polylactic acid/polyethylene glycol and p…
2018
Electrospinning technologies gained considerable interest over the last decade. In this study, it is proposed a systematic study of polylactic acid/polyethylene glycol (PLA/PEG) and polylactic acid/polyethylene oxide (PLA/PEO) electrospun blends at different concentrations. The effect of blend composition and PEG molecular weight on the morphological and mechanical properties of the mats was evaluated. Furthermore, the kinetic release of carvacrol as model drug in phosphate buffer saline at 37℃ was studied and the data were then fitted using an exponential model. The scanning electron microscopy revealed that the morphology of the mats was strongly dependent on the relative ratio PLA:PEG, …
Localized Liquid Secretion from a Photopatterned Liquid-Crystal Polymer Skin
2020
Liquid-releasing artificial skins are made from films made of a smectic liquid-crystal polymer network (LCN) photopolymerized in the presence of a photoactive azobenzene chromophore and a liquid-crystal porogen. The nonreactive porogen phase separates during the polymerization process, and the polymer forms a spongy polymer network filled with liquid. The liquid is excreted from the film when exposed to UV light upon conversion of trans-azobenzene to its cis isomer. Here, localized liquid secretion at preset positions at the polymer film is described. The design principle is based on creating a hybrid molecular architecture with both smectic and nonordered isotropic alignments in a continuo…
PET/PEN Blends of Industrial Interest as Barrier Materials. Part I. Many-Scale Molecular Modeling of PET/PEN Blends
2006
Mesoscale molecular simulations, based on parameters obtained through atomistic molecular dynamics and Monte Carlo calculations, have been used for modeling and predicting the behavior of PET/PEN blends. Different simulations have been performed in order to study and compare pure homopolymer blends with blends characterized by the presence of PET/PEN block copolymers acting as compatibilizer. A many-scale molecular modeling strategy was devised to evaluate PET/PEN blend characteristics, simulate phase segregation in pure PET/PEN blends, and demonstrate the improvement of miscibility due to the presence of the transesterification reaction products. The behavior of distribution densities and …
Exploiting Reaction-Diffusion Conditions to Trigger Pathway Complexity in the Growth of a MOF.
2021
Coordination polymers (CPs), including metal–organic frameworks (MOFs), are crystalline materials with promising applications in electronics, magnetism, catalysis, and gas storage/separation. However, the mechanisms and pathways underlying their formation remain largely undisclosed. Herein, we demonstrate that diffusion-controlled mixing of reagents at the very early stages of the crystallization process (i.e., within ≈40 ms), achieved by using continuous-flow microfluidic devices, can be used to enable novel crystallization pathways of a prototypical spin-crossover MOF towards its thermodynamic product. In particular, two distinct and unprecedented nucleation-growth pathways were experimen…
Nature of water-biochar interface interactions
2012
A poplar biochar obtained by an industrial gasification process was saturated with water and analyzed using fast field cycling (FFC) NMR relaxometry in a temperature range between 299 and 353 K. Results revealed that the longitudinal relaxation rate increased with the increment of the temperature. This behavior was consistent with that already observed for paramagnetic inorganic porous media for which two different relaxation mechanisms can be accounted for: outer- and inner-sphere mechanisms. The former is due to water diffusing from the closest approach distance to infinity, whereas the second is due to water interacting by nonconventional H-bonds to the porous surface of the solid materi…
A dilatometric study of the Lao.8Sr0.2MnO3 sintering behaviour
1997
Abstract The sintering behaviour of La0.8Sr0.2MnO3 has been studied by dilatometry between 1100 and 1800 K in various oxygen potentials [pure oxygen, air and nitrogen (PO2 = 1 × 10−5 bar)]. The starting material was prepared by spray pyrolysis of aqueous solutions of nitrates. Two classical sinter stages, neck formation and grain growth respectively, were evidenced from dilatometric curves and this result was corroborated by scanning electron microscopy (SEM) and X-ray diffraction (XRD) analyses. The rate of densification was found to be directly dependent on oxygen partial pressure, the best conditions being in nitrogen. These results are discussed in terms of vacancy diffusion and oxygen …