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From Charge Density Mismatch to a Simplified, More Efficient Seed-Assisted Synthesis of UZM-4

Takahiko Moteki、Tatsuya Okubo2013-06-18Chemistry of Materials

The charge density mismatch (CDM) approach has been a strategy to apply multiple templates in the zeolite synthesis. In the synthesis of the UZM-4 zeolite, tetraethylammonium (TEA) aluminosilicate solution is used as CDM solution although the TEA cation is not incorporated in the final product. We focused on the aging…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisChemical Synthesis and Characterization

Avoiding Bias Effects in NMR Experiments for Heteronuclear Dipole–Dipole Coupling Determinations: Principles and Application to Organic Semiconductor Materials

Ricardo Kurz、Márcio Fernando Cobo、Eduardo Ribeiro de Azevêdo 等 8 位作者2013-06-18ChemPhysChem

Carbon-proton dipole-dipole couplings between bonded atoms represent a popular probe of molecular dynamics in soft materials or biomolecules. Their site-resolved determination, for example, by using the popular DIPSHIFT experiment, can be challenged by spectral overlap with nonbonded carbon atoms. The problem can be s…

Advanced NMR Techniques and ApplicationsSolid-state spectroscopy and crystallographyElectron Spin Resonance Studies

Electronic and Charge-Transport Properties of the Au3(CH3N═COCH3)3 Crystal: A Density Functional Theory Study

Lingyun Zhu、Veaceslav Coropceanu、Yuanping Yi 等 6 位作者2013-06-18The Journal of Physical Chemistry Letters

Density functional theory was used to investigate the electronic and charge-transport properties of the trinuclear gold Au 3 (CH 3 N═COCH 3 ) 3 crystal. Hole transport is found to be anisotropic and characterized by a very small effective mass of about 0.21 m 0 along the stacking direction of the Au 3 molecules. Inter…

Advanced Chemical Physics StudiesMolecular Junctions and NanostructuresMachine Learning in Materials Science

Designing Cu-Zr Glass Using Multiobjective Genetic Algorithm and Evolutionary Neural Network Metamodels–Based Classical Molecular Dynamics Simulation

Ansul Bansal、Ajitesh Barman、Sudipto Ghosh 等 4 位作者2013-06-18Materials and Manufacturing Processes

Shear deformation analysis and diffusion behavior of Copper-Zirconium Bulk Metallic Glasses (BMG) is studied for different combinations of processing parameters. Melt holding temperature, melt holding duration, cooling rate of melt and composition of BMG are varied to obtain BMGs of different structures. The as-quench…

Glass properties and applicationsMetallic Glasses and Amorphous AlloysCultural and Historical Studies

Extended Release of Theophylline Through Sodium Alginate Hydrogel Beads: Effect of Glycerol on Entrapment Efficiency, Drug Release

Sapana Ahirrao、Paraag Gide、Birendra Shrivastav 等 4 位作者2013-06-18Particulate Science And Technology

Theophylline is the most useful bronchodilators for the treatment of severe reversible bronchospasm. The fluctuations of serum theophylline level in clinical practice and associated central nervous system side effects necessitate the development of an extended release formulation. In the present study, theophylline-lo…

Advanced Sensor and Energy Harvesting MaterialsHydrogels: synthesis, properties, applicationsPolymer Surface Interaction Studies

Coordination Diversity in Mono- and Oligonuclear Copper(II) Complexes of Pyridine-2-Hydroxamic and Pyridine-2,6-Dihydroxamic Acids

Elżbieta Gumienna‐Kontecka、Irina A. Golenya、Agnieszka Szebesczyk 等 6 位作者2013-06-18Inorganic Chemistry

Solution and solid state studies on Cu(II) complexes of pyridine-2-hydroxamic acid (HPicHA) and pyridine-2,6-dihydroxamic acid (H2PyDHA) were carried out. The use of methanol/water solvent allowed us to investigate the Cu(II)-HPicHA equilibria under homogeneous conditions between pH 1 and 11. In agreement with ESI-MS…

Metal complexes synthesis and propertiesCrystal structures of chemical compoundsMagnetism in coordination complexes

Formation of nanogratings in a transparent material with tunable ionization property by femtosecond laser irradiation

Fadhil A. Umran、Yang Liao、Mazin M. Elias 等 7 位作者2013-06-18Optics Express

Irradiation inside some transparent materials such as fused silica can induce nanograting structures at the focal area. Here, we investigate experimentally how the nanograting formation can be influenced by tuning the ionization property of the transparent material, which is achieved by irradiation inside a porous gla…

Glass properties and applicationsLaser Material Processing TechniquesNonlinear Optical Materials Studies

Thermal and mechanical durability of starch-based dual polymer coatings in the press forming of paperboard

Panu Tanninen、Henry Lindell、Esa Saukkonen 等 4 位作者2013-06-18Packaging Technology and Science

The runnability and convertibility of biopolymer dispersion–coated paperboard were determined using a novel adjustable packaging line equipped with a tray-pressing mould. Commercial paperboard was dispersion barrier coated on the back-side using a dual polymer system containing both a synthetic and a renewable biopoly…

Nanocomposite Films for Food PackagingRecycling and Waste Management TechniquesMaterial Properties and Processing

Analytical model for self-heating in nanowire geometries

D. Patrick Hunley、Stephen L. Johnson、Roel L. Flores 等 5 位作者2013-06-18Journal of Applied Physics

An analytical closed form diffusive model is developed of Joule heating in a device consisting of a nanowire connected to two contacts on a substrate. This analytical model is compared to finite-element simulations and demonstrates excellent agreement over a wider range of system parameters in comparison to other rece…

Molecular Junctions and NanostructuresNanowire Synthesis and ApplicationsThermal properties of materials

Chiral, Racemic, and Meso-Lithium Tartrate Framework Polymorphs: A Detailed Structural Analysis

Hamish H.‐M. Yeung、Monica Kosa、Michele Parrinello 等 4 位作者2013-06-18Crystal Growth & Design

Following our previous report of five anhydrous lithium tartrates 1 – 5 (tart = C 4 H 4 O 6 2– ), we have synthesized and solved the single crystal structures of four new I 1 O 2 inorganic–organic frameworks, all with the same chemical formula, Li 2 (tart). Reactions between lithium acetate and the meso, chiral, and r…

Metal-Organic Frameworks: Synthesis and ApplicationsCrystal Structures and PropertiesChemical Synthesis and Characterization

Solid-State Organization and Ambipolar Field-Effect Transistors of Benzothiadiazole-Cyclopentadithiophene Copolymer with Long Branched Alkyl Side Chains

Wojciech Pisula、Hoi Nok Tsao、Dmytro Dudenko 等 11 位作者2013-06-18Polymers

The solid-state organization of a benzothiadiazole-cyclopentadithiophene copolymer with long, branched decyl-tetradecyl side chains (CDT-BTZ-C14,10) is investigated. The C14,10 substituents are sterically demanding and increase the π-stacking distance to 0.40 nm from 0.37 nm for the same polymer with linear hexadecyls…

Organic Electronics and PhotovoltaicsConducting polymers and applicationsOrganic and Molecular Conductors Research

Laboratory Evaluation of Asphalt Mixtures Containing Bio-Binder Technologies

Louay N. Mohammad、Mostafa A. Elseifi、Samuel B. Cooper 等 5 位作者2013-06-18OpenAlex

The use of bio-binder as a replacement to petroleum-based asphalt binders has received considerable attention in recent years. The objective of this study was to conduct a comprehensive laboratory evaluation of asphalt mixtures containing bio-binder technology at a content of 20, 25.5, 30, and 50%. To achieve this obj…

Concrete and Cement Materials ResearchAsphalt Pavement Performance EvaluationNatural Fiber Reinforced Composites

Homolytic Cleavage of FeS Bonds in Rubredoxin under Mechanical Stress

Guilherme M. Arantes、Anirban Bhattacharjee、Martin J. Field2013-06-18Angewandte Chemie International Edition

Spin is the thing: Iron–sulfur proteins of the rubredoxin family only have one Fe center coordinated by four cysteine residues (see picture, Fe orange). A multiscale modeling approach is used to see if FeS bond dissociation in these iron–sulfur clusters occurs by heterolytic fission or homolytic cleavage. As Fe compl…

Magnetism in coordination complexesMetalloenzymes and iron-sulfur proteinsMetal-Catalyzed Oxygenation Mechanisms

Observation of Precessional Magnetization Dynamics in L10-FePt Thin Films with Different L10 Order Parameter Values

Satoshi Iihama、Shigemi Mizukami、Nobuhito Inami 等 9 位作者2013-06-18Japanese Journal of Applied Physics

Fast magnetization precession was observed in L10-FePt thin films with different L10 order parameter values by all optical pump–probe technique. Precession frequency was varied widely for the films with different order parameter, which is due to large difference in perpendicular magnetic anisotropy. Gilbert damping co…

Magnetic properties of thin filmsMagnetic Properties and ApplicationsMagneto-Optical Properties and Applications

First studies of ITER-diagnostic mirrors in a tokamak with an all-metal interior: results of the first mirror test in ASDEX Upgrade

A. Litnovsky、Maria Matveeva、A. Herrmann 等 20 位作者2013-06-18Nuclear Fusion

In ITER, mirrors will be used as plasma-viewing elements in all optical and laser diagnostics. In the harsh environment, mirror performance will degrade hampering the operation of associated diagnostics. The most adverse effect on mirror performance is caused by the deposition of impurities. It is expected that the mo…

Magnetic confinement fusion researchLaser-Plasma Interactions and DiagnosticsFusion materials and technologies

Enhanced Electronic Properties of Pt@Ag Heterostructured Nanoparticles

Anh Thi Ngoc Dao、Derrick Mott、Koichi Higashimine 等 4 位作者2013-06-18Sensors

Platinum coated by silver nanoparticles was synthesized, which displays a unique structure where polycrystalline platinum particles are completely encapsulated in continuous monocrystalline silver shells. These particles display accentuated electronic properties, where the silver shells gain electron density from the…

Gold and Silver Nanoparticles Synthesis and ApplicationsAdvanced biosensing and bioanalysis techniquesBiosensors and Analytical Detection

Alternative Transportation Fuels: Utilisation in Combustion Engines

M. K. Gajendra Babu、K.A. Subramanian2013-06-18OpenAlex

The feasibility of using alternative fuels in an effort to support sustainability in the transportation sector is explored in this book. Potential avenues for using various alternative fuels are assessed, as well as their effect on the environment, such as global warming and climate change. Experimental investigations…

Advanced Combustion Engine TechnologiesCatalytic Processes in Materials ScienceBiodiesel Production and Applications

Boehmite Supported Pyrene Polyamine Systems as Probes for Iodide Recognition

Esther Carbonell、Estefanía Delgado‐Pinar、Javier Pitarch‐Jarque 等 5 位作者2013-06-18The Journal of Physical Chemistry C

New organic–inorganic fluorescent probes made by attaching the tripodal polyamine (tris(2-aminoethyl))amine ( tren ), propylamine, or diethylenetriamine functionalized with pyrene as a fluorophore to an γ-aluminum oxohydroxide matrix have been prepared and studied both in solution and supported on the surface of boehm…

Molecular Sensors and Ion DetectionLuminescence and Fluorescent MaterialsAnalytical Chemistry and Sensors

Doped YbRh 2 Si 2 : Not Only Ferromagnetic Correlations but Ferromagnetic Order

Stefan Lausberg、A. Hannaske、Alexander Steppke 等 11 位作者2013-06-18Physical Review Letters

${\mathrm{YbRh}}_{2}{\mathrm{Si}}_{2}$ is a prototypical system for studying unconventional antiferromagnetic quantum criticality. However, ferromagnetic correlations are present which can be enhanced via isoelectronic cobalt substitution for rhodium in $\mathrm{Yb}({\mathrm{Rh}}_{1\ensuremath{-}x}{\mathrm{Co}}_{x}{)}…

Physics of Superconductivity and MagnetismRare-earth and actinide compoundsIron-based superconductors research

Hydrophobic cryogels for DNA adsorption: Effect of embedding of monosize microbeads into cryogel network on their adsorptive performances

M. Emin Çorman、Nilay Bereli、Serpil Özkara 等 5 位作者2013-06-18Biomedical Chromatography

As alternative hydrophobic adsorbent for DNA adsorption, supermacroporous cryogel disks were synthesized via free radical polymerization. In this study, we have prepared two kinds of cryogel disks: (i) poly(2-hydroxyethyl methacrylate-N-methacryloyl-l-tryptophan) [p(HEMA-MATrp)] cryogel containing specific hydrophobic…

Nanoparticle-Based Drug DeliveryHydrogels: synthesis, properties, applicationsProtein purification and stability