Enhancement of vertical phase separation in sequentially deposited organic photovoltaics through the independent processing of additives

Herein,the impact of the independent control of processing additives on vertical phase separation in sequentially deposited (SD) organic photovoltaics (OPVs) and its subsequent effects on charge carrier kinetics at the electron donor-acceptor interface are investigated.The film morphology exhibits notable variations,significantly depending on the layer to which 1,8-diiodooctane (DIO) was applied.Grazing incidence wide-angle X-ray scattering analysis reveals distinctly separated donor/acceptor phases and vertical crystallinity details in SD films.Time-of-flight secondary ion mass spectrometry analysis is employed to obtain component distributions in diverse vertical phase structures of SD films depending on additive control.In addition,nanosecond transient absorption spectroscopy shows that DIO control significantly affects the dynamics of separated charges in SD films.In SD OPVs,DIO appears to act through distinct mechanisms with minimal restriction,depending on the applied layer.This study emphasizes the significance of morphological optimization in improving device performance and underscores the importance of independent additive control in the advancement of OPV technology.

A Cu-Pd alloy catalyst with partial phase separation for the electrochemical CO_(2) reduction reaction

Cu catalysts can convert CO_(2) through an electrochemical reduction reaction into a variety of useful carbon-based products.However,this capability provides an obstacle to increasing the selectivity for a single product.Herein,we report a simple fabrication method for a Cu-Pd alloy catalyst for use in a membrane electrode assembly(MEA)-based CO_(2) electrolyzer for the electrochemical CO_(2) reduction reaction(ECRR)with high selectivity for CO production.When the composition of the Cu-Pd alloy catalyst was fabricated at 6:4,the selectivity for CO increased and the production of multi-carbon compounds and hydrogen is suppressed.Introducing a Cu-Pd alloy catalyst with 6:4 ratio as the cathode of the MEAbased CO_(2) electrolyzer showed a CO faradaic efficiency of 92.8%at 2.4 V_(cell).We assumed that these results contributed from the crystal planes on the surface of the Cu-Pd alloy.The phases of the Cu-Pd alloy catalyst were partially separated through annealing to fabricate a catalyst with high selectivity for CO at low voltage and C_(2)H_4 at high voltage.The results of CO-stripping testing confirmed that when Cu partially separates from the lattice of the Cu-Pd alloy,the desorption of~*CO is suppressed,suggesting that C-C coupling reaction is favored.

Physical information-enhanced graph neural network for predicting phase separation

Although phase separation is a ubiquitous phenomenon, the interactions between multiple components make it difficult to accurately model and predict. In recent years, machine learning has been widely used in physics simulations. Here,we present a physical information-enhanced graph neural network(PIENet) to simulate and predict the evolution of phase separation. The accuracy of our model in predicting particle positions is improved by 40.3% and 51.77% compared with CNN and SVM respectively. Moreover, we design an order parameter based on local density to measure the evolution of phase separation and analyze the systematic changes with different repulsion coefficients and different Schmidt numbers.The results demonstrate that our model can achieve long-term accurate predictions of order parameters without requiring complex handcrafted features. These results prove that graph neural networks can become new tools and methods for predicting the structure and properties of complex physical systems.

Binary fluids in mesoporous materials: Phase separation studied by NMR relaxation and diffusion

Relaxation and diffusion measurements were carried out on single and binary liquids filling the pore space of controlled porous glass Vycor with an average pore size of about 4 nm.The dispersion of the longitudinal relaxation time Tr is discussed as a means to identify liquid-surface interaction based on existing models developed for metal-free glass surfaces.In addition,the change of T1 and T2 with respect to their bulk values is discussed,in particular T2 serves as a probe for the strength of molecular interactions.As the native glass surface is polar and contains a large amount of hydroxyl groups,a pronounced interaction of polar and protic adsorbate liquids is expected;however,the T dispersion,and the corresponding reduction of T2,are also observed for non-polar liquids such as alkanes and cyclohexane.Deuterated liquids are employed for simplifying data analysis in binary systems,but also for separating the respective contributions of intra-and intermolecular interactions to the overall relaxation rate.Despite the lack of paramagnetic impurities in the glass material,H and 2H relaxation dispersions of equivalent molecules are frequently found to differ from each other,suggesting intermolecular relaxation mechanisms for the'H nuclei.The variation of the T dispersion when comparing single and binary systems gives clear evidence for the preferential adsorption of one of the two liquids,suggesting complete phase separation in several cases.Measurement of the apparent tortuosity by self-diffusion experiments supports the concept of a local variation of sample composition within the porespace.

Microporous carbon nanofibers prepared by combining electrospinning and phase separation methods for supercapacitor

Microporous carbon nanofibers (MCNFs) derived from polyacrylonitrile nanofibers were fabricated via electrospinning technology and phase separation in the presence of polyvinylpyrrolidone (PVP). PVP together with a mixed solvent of N, N-Dimethylformamide and dimethyl sulfoxide was used as pore forming agent. The influences of PVP content in casting solution on the structure and electrochemical performance of the MCNFs were also investigated. The highest capacitance of 200 F/g was obtained on a three-electrode system at a scan rate of 0.5 A/g. The good performance was owing to the high specific surface area and the large amount of micro-pores, which enhanced the absorption and the transportation efficiency of electrolyte ion during charge/discharge process. This research indicated that the combination of electrospinning and phase separation technology could be used to fabricate microporous carbon nanofibers as electrode materials for supercapacitors with high specific surface area and outstanding electrochemical performance. (C) 2016 Science Press and Dalian Institute of Chemical Physics, Chinese Academy of Sciences. Published by Elsevier B.V. and Science Press. All rights reserved.

Dynamic scaling behaviour of late-stage phase separation in Ni75AlxV25-x alloys

The dynamic scaling behaviour of late-stage phase separation and coarsening mechanisms of L12 and D022 in Ni75AlxV25-x （3 ≤ x ≤ 10, at.%） alloys are studied using the microscopic phase-field dynamic model. The microelaso ticity field is incorporated into the diffusion dynamic model. The results show the morphology and coarsening dynamics being greatly changed by the elastic interactions among different precipitates, the particles aligning along the dominant directions, the average domain size （ADS） of L12 and D022 deviating from the exponent of temporal power-law, and the growth slowing down due to the increasing of elastic interactions. The dynamic scaling regime of late-stage coarsening of the precipitates is attained. Thus the scaling behaviour of structure function is also applicable for elastic interaction systems. It is also found that the variations of ADS and scaling function depend on the volume fraction of precipitates.

PREPARATION OF MICROPOROUS ULTRA HIGH MOLECULAR WEIGHT POLYETHYLENE (UHMWPE) BY THERMALLY INDUCED PHASE SEPARATION OF A UHMWPE/LIQUID PARAFFIN MIXTURE

Ultra-high molecular weight polyethylene (UHMWPE) with a microporous structure was prepared via thermally induced phase separation (TIPS).Liquid paraffin (LP) was used as a diluent in the preparation of microporous UHMWPE. Small angle laser light scattering (SALLS) and differential scanning calorimetry (DSC) were used to determine the phase separation temperatures,i.e.the cloud points and the dynamic crystallization temperatures,respectively.It was found that the cloudI points were coincident with the cryst...

METASTABLE PHASE SEPARATION OF Fe_(50)Cu_(50) HYPOPERITECTIC ALLOY UNDER SPACE SIMULATION CONDITIONS

A 3m drop-tube was used to investigate the solidification of Fe50Cu50 hypoperitectic alloy. The falling droplets solidified as spheres and splats. The obtained particles range from 1000μm to 80μm in diameter. It was found that the phase separation occurred if the Fe-Cu liquid was undercooled to a certain extent before solidification.In the big particles macroscopic separation of Fe-rich phase always appeared in the cented of the particles, and in the small ones the Fe-rich phase usually solidified as little spheres. In the flakes the Fe-rich and Cu-rich layers alternatively displayed from top to bottom.

Fabrication of poly(vinylidene fluoride) membrane via thermally induced phase separation using ionic liquid as green diluent

Ionic liquid(IL),1-butyl-3-methylimidazolium hexafluorophosphate([BMIM]PF6)as a new and environmentally friendly diluent was introduced to prepare poly(vinylidene fluoride)(PVDF)membranes via thermally induced phase separation(TIPS).Phase diagram of PVDF/[BMIM]PF6 was measured.The effects of polymer concentration and quenching temperature on the morphologies,properties,and performances of the PVDF membranes were investigated.When the polymer concentration was 15 wt%,the pure water flux of the fabricated membrane was up to nearly 2000 L·m-2·h-1,along with adequate mechanical strength.With the increasing of PVDF concentration and quenching temperature,mean pore size and water permeability of the membrane decreased.SEM results showed that PVDF membranes manufactured by ionic liquid(BMIm PF6)presented spherulite structure.And the PVDF membranes were represented asβphase by XRD and FTIR characterization.It provides a new way to prepare PVDF membranes with piezoelectric properties.

FORMATION AND MICROSTRUCTURE OF POLYETHYLENE MICROPOROUS MEMBRANES THROUGH THERMALLY INDUCED PHASE SEPARATION

Microporous membranes of low-high density polyethylene and their blends were prepared bythermally-induced phase separation of polymer/long-aliphatic chain alcohol (diluent) mixtures.The microstructures of this particular membrane, which depends on the diluent properties,polymer concentration and cooling rate, were observed by scanning electron microscopy.'Beehive-type,'leafy-like, and lacy porous structure morphologies can be formed,depending onthe blend composition and phase separation conditions, which were discussed by the polymer anddiluent crystallization processes.

PREPARATION OF HIGH DENSITY POLYETHYLENE/POLYETHYLENE-BLOCK-POLY(ETHYLENE GLYCOL)COPOLYMER BLEND POROUS MEMBRANES VIA THERMALLY INDUCED PHASE SEPARATION PROCESS AND THEIR PROPERTIES

High density polyethylene （HDPE）/polyethylene-block-poly（ethylene glycol） （PE-b-PEG） blend porous membranes were prepared via thermally induced phase separation （TIPS） process using diphenyl ether （DPE） as diluent. The phase diagrams of HDPE/PE-b-PEG/DPE systems were determined by optical microscopy and differential scanning calorimetry （DSC）. By varying the content of PE-b-PEG, the effects of PE-b-PEG copolymer on morphology and crystalline structure of membranes were studied by scanning electron microscopy （SEM） and wide angle X-ray diffraction （WAXD）. The chemical compositions of whole membranes and surface layers were characterized by elementary analysis, Fourier transform infrared spectroscopy-attenuated total reflection （FTIR-ATR） and X-ray photoelectron spectroscopy （XPS）. Water contact angle, static protein adsorption and water flux experiments were used to evaluate the hydrophilicity, antifouling and water permeation properties of the membranes. It was found that the addition of PE-b-PEG increased the pore size of the obtained blend membranes. In the investigated range of PE-b-PEG content, the PEG blocks could not aggregate into obviously separated domains in membrane matrix. More importantly, PE-b-PEG could not only be retained stably in the membrane matrix during membrane formation, but also enrich at the membrane surface layer. Such stability and surface enrichment of PE-b-PEG endowed the blend membranes with improved hydrophilicity, protein absorption resistance and water permeation properties, which would be substantially beneficial to HDPE membranes for water treatment application.

PHASE SEPARATION BEHAVIOR OF SURLYN IN POLY (ETHYLENE TEREPHTHALTE)

The phase separation behavior of blend of Surlyn and poly(ethylene terephthalate) (PET) has been studied by scanning electron microscopy and IR. It is shown that particles of Surlyn are dispersed in PET matrix, and this phase separation is controlled by heat-treated conditions of the blend.

Effects of Ni addition on liquid phase separation and giant magnetoresistance of Cu-Co alloys

The effects of Ni addition on the liquid phase separation and giant magnetoresi stance (GMR) of Cu Co alloys were discussed. The results reveal that Ni additio n can partially restrain the liquid phase separation of Cu Co alloys, resultin g in a decrease of volume fraction for the Co rich particles separated from the liquid phase and in refined microstructures. The composition analyses indicate t hat Ni is dissolved in both the Co rich and the Cu rich phases, but Ni content in the Co rich phase is much higher than that in the Cu matrix. At the same ti me, Ni addition enhance the solubility between Cu and Co, especially Cu in Co s olid solution. Ni alloying into Cu Co alloys can fully prevent the liquid phase separation during melt spinning, which is very beneficial to improve GMR of Cu Co alloys.

EFFECT OF DILUENTS ON CRYSTALLIZATION OF POLY(VINYLIDENE FLUORIDE) AND PHASE SEPARATED STRUCTURE IN A TERNARY SYSTEM via THERMALLY INDUCED PHASE SEPARATION

The phase diagram of a ternary system of PVDF,dibutyl phthalate (DBP) and di(2-ethylhexyl) phthalate (DEHP) was determined in terms of a pseudo binary system with the same polymer concentration and different DBP content in diluent mixture.The experimental results showed that as the DBP content increased in diluent mixture,the phase separation changed from liquid-liquid phase separation to solid-liquid phase separation,and both the cloudy point for L-L phase separation and crystallization temperature shifted...

Fabrication of Poly(vinylidene fluoride) /Polysulfone Flat Blend Membranes via Thermally Induced Phase Separation Process for Water Treatment

Poly(vinylidene fluoride) /polysulfone(PVDF/PSF) flat blend membrane was prepared via thermally induced phase separation(TIPS) technique.The membrane formation mechanism and membrane structure were investigated and the effects of PSF/PVDF weight ratio on morphology,crystallinity,porosity,and mechanical properties of the membrane were discussed.The relationship between membrane structure and performances,such as pure water flux and the rejection of carbonic black,was also discussed.It was found that solid-liquid(S-L) phase separation occurred for the PVDF/PSF/diluent system.The addition of PSF influences structure and crystallinity of the membrane,which in turn influences mechanical properties and performances of the membrane.The results reveal that it is possible to obtain network structure via S-L phase separation by blending the polymer,which has a partial compatibility with PVDF.

Metastable phase separation and rapid solidification of undercooled Co_(40)Fe_(40)Cu_(20) alloy

The metastable liquid phase separation and rapid solidification behaviors of Co_（40） Fe_（40） Cu_（20） alloy were investigated by using differential thermal analysis（DTA） in combination with glass fluxing and electromagnetic levitation（EML） techniques. The critical liquid phase separation undercooling for this alloy was determined by DTA to be 174 K. Macrosegregation morphologies are formed in the bulk samples processed by both DTA and EML. It is revealed that undercooling level, cooling rate, convection, and surface tension difference between the two separated phases play a dominant role in the coalescence and segregation of the separated phases. The growth velocity of the（Fe,Co） dendrite has been measured as a function of undercooling up to 275 K. The temperature rise resulting from recalescence increases linearly with the increase of undercooling because of the enhancement of recalescence. The slope change of the recalescence temperature rise versus undercooling at the critical undercooling also implies the occurrence of liquid demixing.

An Observation on the Microphase Separation of Poly(methyl methacrylate)-block-Polystyrene Copolymer

The phase behavior of a well-defined poly(methyl methacrylate)- b- polystyrene block copolymer was studied by transmission electron microscope. The results show that a microphase transition may have occurred in the copolymer film. A kind of lamellae and an ordered bicontinuous double-diamond morphology are observed clearly. The lamellar morphology reveals a larger period of about 400 nm.

Phase separation and super diffusion of binary mixtures of active and passive particles

Computer simulations were performed to study the dense mixtures of passive particles and active particles in two dimensions.Two systems with different kinds of passive particles(e.g.,spherical particles and rod-like particles)were considered.At small active forces,the high-density and low-density regions emerge in both systems,indicating a phase separation.At higher active forces,the systems return to a homogeneous state with large fluctuation of particle area in contrast with the thermo-equilibrium state.Structurally,the rod-like particles accumulate loosely due to the shape anisotropy compared with the spherical particles at the high-density region.Moreover,there exists a positive correlation between Voronoi area and velocity of the particles.Additionally,a small number of active particles capably give rise to super-diffusion of passive particles in both systems when the self-propelled force is turned on.

Improving the performance of polymer solar cells by adjusting the crystallinity and nanoscale phase separation

In this paper, we report a high-perfornmnce P3HT/PCBM bulk-heterojunction solar cell with a power conversion efficiency of 4.85% fabricated by adjusting the polymer crystallinity and nanoscale phase separation using an ultrasonic irradiation mixing approach for the polymer. The grazing incidence X-ray diffraction, UV/Vis spectroscopic, and atomic force microscopic measurement results for the P3HT/PCBM blend films reveal that the P3HT/PCBM film fabricated by ultrasonic irradiation mixing of the P3HT and PCBM solutions for 10 min has a higher degree of crystallinity, a higher absorption efficiency, and better phase separation, which together account for the higher charge transport properties and photovoltaic cell performance.

USING TWO-DIMENSIONAL TIME RESOLVED LIGHT SCATTERING TO STUDY THE CURE REACTION INDUCED PHASE SEPARATION PROCESS OF EPOXY-AMINE-POLYETHERSULFONE BLEND WITH SECONDARY PHASE SEPARATION

The generalized two-dimensional correlation analysis based on time-resolved light scattering patterns （2D TRLS） has been employed to study the phase separation process of an epoxy-amine-polyethersulfone blend in which the secondary phase separation takes place. The results of the 2D TRLS provided more detailed information that was not readily observed in the 1D TRLS patterns. （i） During the first process of phase separation, the sequential order of coarsening in size of the domains among the larger and smaller ones has been reversed between the diffusion regime and the hydrodynamic regime. （ii） The change of the larger domains in size, due to the hydrodynamic flow in the late stage of the first phase separation process, keeps on taking place earlier than that of the new domains appeared in the secondary phase separation process. （iii） During the secondary phase separation process the size growth of the smaller domains takes place earlier than that of the larger ones, probably due to the assumption that the coarsening mode could decrease the interface tension more quickly.