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Comparison of different models of motion in a crowded environment: a Monte Carlo study

Piotr Polanowski、Andrzej Sikorski2017-01-01Soft Matter

In this paper we investigate the motion of molecules in crowded environments for two dramatically different types of molecular transport. The first type is realized by the dynamic lattice liquid model, which is based on a cooperative movement concept and thus, the motion of molecules is highly correlated. The second o…

Material Dynamics and PropertiesTheoretical and Computational PhysicsSpectroscopy and Quantum Chemical Studies

Synthesis, mechanism and efficient modulation of a fluorescence dye by photochromic pyrazolone with energy transfer in the crystalline state

Yinhua Li、Jixi Guo、Anjie Liu 等 6 位作者2017-01-01RSC Advances

The emission intensity of <bold>DPA</bold> can be efficiently switched by fluorescence resonance energy transfer between the energy donor <bold>DPA</bold> and acceptor <bold>1b</bold> .

Radical Photochemical ReactionsLuminescence and Fluorescent MaterialsPhotochromic and Fluorescence Chemistry

Rheology of Thermal Interface Materials Composed of Silicone Gels

Keizo Chano、G. M. Poliskie、J. Fregoso2017-01-01IEEE Transactions on Components Packaging and Manufacturing Technology

A reliable thermal interface material (TIM) typically has a low storage modulus (G') and a tan(δ) less than one; these mechanical properties are crucial for minimizing contact resistance (Rc). This paper demonstrates the correlation between storage modulus (G') and the crosslink density of silicone gels. Formulations…

Thermal properties of materialsAdhesion, Friction, and Surface InteractionsThermal Radiation and Cooling Technologies

Ion-pair coordination driven stimuli-responsive one-dimensional supramolecular helicate

Sourenjit Naskar、Chumki Dalal、Pradyut Ghosh2017-01-01Chemical Communications

coordination driven one dimensional (1D) smart supramolecular helical assembly of a new heteroditopic ligand was achieved. Moreover, thermo- and chemo-responsive transformation/disassembly/reassembly of the helical superstructure was also demonstrated.

Metal-Organic Frameworks: Synthesis and ApplicationsSupramolecular Chemistry and ComplexesSupramolecular Self-Assembly in Materials

Centrosymmetric to noncentrosymmetric structural transformation of new quaternary selenides induced by isolated dimeric [Sn 2 Se 4 ] units: from Ba 8 Ga 2 Sn 7 Se 18 to Ba 10 Ga 2 Sn 9 Se 22

Yanyan Li、Jinqiu Wang、Pengfei Liu 等 6 位作者2017-01-01RSC Advances

An interesting centrosymmetric to noncentrosymmetric structure transformation from Ba <sub>8</sub> Ga <sub>2</sub> Sn <sub>7</sub> Se <sub>18</sub> to Ba <sub>10</sub> Ga <sub>2</sub> Sn <sub>9</sub> Se <sub>22</sub> induced by isolated dimeric [Sn <sub>2</sub> Se <sub>4</sub> ] units was reported.

Crystal Structures and PropertiesIron-based superconductors researchSolid-state spectroscopy and crystallography

Defect induced phonon scattering for tuning the lattice thermal conductivity of SiO2 thin films

Sen Cao、Hu He、Wenhui Zhu2017-01-01AIP Advances

In this work, the thermal properties of nanoscale SiO2 thin films have been systematically investigated with respect to the thickness, crystal orientations and the void defects using non-equilibrium molecular-dynamics (NEMD) simulation. Size effect for the lattice thermal conductivity of nanoscale SiO2 thin films was…

Advanced Thermoelectric Materials and DevicesThermal properties of materialsThermal Radiation and Cooling Technologies

Study on the efficient PV/TE characteristics of the self-assembled thin films based on bismuth telluride/cadmium telluride

Vivekanandan Raman、Dinah Punnoose、P. Baraneedharan 等 8 位作者2017-01-01RSC Advances

To effectively use the entire solar spectrum for energy conversion, a new type of solar cell based on a Bi <sub>2</sub> Te <sub>3</sub> /CdTe composite in a core shell structure was designed and prepared using a wet chemical method.

Perovskite Materials and ApplicationsQuantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin Films

Fluorescence of ZnO/carbon mixture and application in acid rain detection

Kai‐Kai Liu、Chongxin Shan、Hongzhen Liu 等 5 位作者2017-01-01RSC Advances

ZnO and carbon mixture as dual-emission ratiometric fluorescent sensor of acid rain have been demonstrated.

Air Quality and Health ImpactsGas Sensing Nanomaterials and SensorsCarbon and Quantum Dots Applications

Successive lithiation of acetylene, ethylene and benzene: a comprehensive computational study of large static second hyperpolarizability

Avijit Mondal、Kaushik Hatua、Ria Sinha Roy 等 4 位作者2017-01-01Physical Chemistry Chemical Physics

a.u. obtained with a relatively larger basis set established the earlier prediction of Sadlej et al. [Phys. Chem. Phys. Chem., 2000, 2, 3393-3399] where degenerate non-dipolar transitions in low lying excited states play the crucial role. The successive lithiation results in gradual red shifting of transition energy l…

Nonlinear Optical Materials ResearchAdvanced NMR Techniques and ApplicationsSolid-state spectroscopy and crystallography

Influence of incubation temperature on biofilm formation and corrosion of carbon steel by Serratia marcescens

Ardiyan Harimawan、Hary Devianto、Ignatius Chandra Kurniawan 等 4 位作者2017-01-01AIP conference proceedings

Microbial induced corrosion (MIC) or biocorrosion is one type of corrosion, directly or indirectly influenced by microbial activities, by forming biofilm and adhering on the metal surface. When forming biofilm, the microorganisms can produce extracellular products which influence the cathodic and anodic reactions on m…

Corrosion Behavior and InhibitionOdor and Emission Control TechnologiesMarine Biology and Environmental Chemistry

Feasibility of Using Foamed Styrene Maleic Anhydride (SMA) Co-polymer in Wood Based Composites

Mustafa Zor、Nurgül Tankut、Alper Kızıltaş 等 5 位作者2017-01-01Drvna industrija

Wood plastic composites (WPCs) have often been used in consumer applications, automotive industry and exterior construction. WPCs consist mostly of wood and thermoplastic polymer. WPCs can have superior outdoor durability and much lower maintenance costs than regular wood. WPCs can be used instead of wood. Styrene mal…

Natural Fiber Reinforced CompositesEpoxy Resin Curing ProcessesPolymer Foaming and Composites

Stabilization and transformation of Pt nanocrystals supported on ZnAl 2 O 4 spinel

Weizhen Li、Libor Kovařík、Yingwen Cheng 等 7 位作者2017-01-01RSC Advances

We report remarkable stability of Pt crystals supported on {111} facet of ZnAl <sub>2</sub> O <sub>4</sub> under harsh oxidizing atmosphere, we also identified segregation of ZnAl <sub>2</sub> O <sub>4</sub> to ZnO and Al <sub>2</sub> O <sub>3</sub> and formation of PtZn for Pt supported on other facets of ZnAl <sub>2…

Catalytic Processes in Materials ScienceCopper-based nanomaterials and applicationsAmmonia Synthesis and Nitrogen Reduction

Enhanced selective oxidation of h-BN nanosheet through a substrate-mediated localized charge effect

Keke Mao、Xiaojun Wu、Jinlong Yang2017-01-01Physical Chemistry Chemical Physics

molecule on the h-BN sheet deposited on Ni, Co, or Cu substrate were almost spontaneous with negligible energy barrier, distinctly different from that on the freestanding h-BN sheet, which has ultra-high chemical stability. In particular, the enhanced oxidation of h-BN sheet can be confined in the nanoscale region due…

Graphene research and applications2D Materials and ApplicationsBoron and Carbon Nanomaterials Research

Synthesis of bright red-emissive dicyanoetheno-bridged hexa-peri-hexabenzocoronene dimers

Kazuma Oda、Satoru Hiroto、Ichiro Hisaki 等 4 位作者2017-01-01Organic & Biomolecular Chemistry

The introduction of a dicyanomethyl anion group to hexa-peri-hexabenzocoronene (HBC) substantially enhanced the emission properties of HBC due to a large perturbation of its electronic structure. In addition, dicyanoetheno-bridged HBC dimers obtained from oxidation of a dicyanomethyl HBC anion exhibited bright red emi…

Organic Electronics and PhotovoltaicsLuminescence and Fluorescent MaterialsSynthesis and Properties of Aromatic Compounds

Comparative Cytotoxicity Induced by Zinc Oxide Nanoparticles in Human Prostate Cells

Juan Fu、Xianli Zeng、Nongyue He2017-01-01Journal of Nanoscience and Nanotechnology

Despite increasing biomedical applications of zinc oxide nanoparticles (ZnO NPs), there is a lack of information concerning the biological effects of ZnO NPs on human cells. The purpose of this study was to assess the comparative cytotoxicity in human prostate cells (PC-3 and RWPE-1) exposure to 20-nm ZnO NPs. Exposur…

Nanoparticle-Based Drug DeliveryNanoparticles: synthesis and applicationsRNA Interference and Gene Delivery

Two- and three-phase equilibria of polydisperse Yukawa hard-sphere fluids confined in random porous media: high temperature approximation and scaled particle theory

Taras Hvozd、Yu. V. Kalyuzhnyi2017-01-01Soft Matter

We have studied the phase behavior of polydisperse Yukawa hard-sphere fluid confined in random porous media using extension and combination of high temperature approximation and scaled particle theory. The porous media are represented by the matrix of randomly placed hard-sphere obstacles. Due to the confinement, poly…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesTheoretical and Computational Physics

Isolation of an unusual [Cu 6 ] nanocluster through sequential addition of copper( i ) to a polynucleating ligand

Andreas Phanopoulos、Mark R. Warren、Andrew J. P. White 等 5 位作者2017-01-01Dalton Transactions

Addition of 2 equiv. of CuI to a [Cu] <sub>4</sub> multimetallic complex results in cluster formation leading to the isolation of a rare bicapped tetrahedral [Cu <sub>6</sub> I <sub>2</sub> ] cluster that is stabilised by two conformationally constrained polynucleating ligands.

Metal complexes synthesis and propertiesMagnetism in coordination complexesNanocluster Synthesis and Applications

Effect of anneal temperature on fluorine doped tin oxide (FTO) nanostructured fabricated using hydrothermal method

Mohd Khairul Ahmad、Nur Ayuni Marzuki、Chin Fhong Soon 等 11 位作者2017-01-01AIP conference proceedings

FTO thin films were prepared by the hydrothermal method at anneal temperature of 100°C-400°C using pentahydrate stannic chloride (SnCl4.5H2O) and ammonium fluoride (NH4F) as precursors, and a mixture of DI water, acetone and hydrochloride as a solvent. The X-ray diffraction studies confirmed the tetragonal structure w…

ZnO doping and properties

Development of numerical simulation method for melt relocation behavior in nuclear reactors: validation and applicability for actual core structures

Susumu Yamashita、Kazuyuki Tokushima、Masaki Kurata 等 4 位作者2017-01-01Mechanical Engineering Journal

In order to precisely investigate molten core relocation behavior in severe accidents, we have been developing the detailed and phenomenological numerical simulation code named JUPITER for predicting the molten core behavior with melting and solidification based on computational fluid dynamics (CFD) including the thre…

Nuclear reactor physics and engineeringNuclear Materials and PropertiesNuclear Engineering Thermal-Hydraulics

COTTON GINNERS HANDBOOK: Textile Industry Needs

Christopher D. Delhom、Vikki Martin、Martin K. Schreiner2017-01-01˜The œjournal of cotton science/Journal of cotton science

The immediate customers of cotton gins are the producers; however, the ultimate customers are textile mills and consumers. The ginner has the challenging task to satisfy both producers and the textile industry. Classing and grading systems are intended to assign an economic value to the bales that relates to textile m…

Textile materials and evaluations