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Correcting resolution bias in electron density maps of organic molecules derived by direct methods from powder data

Angela Altomare、Corrado Cuocci、Carmelo Giacovazzo 等 5 位作者2008-05-07Journal of Applied Crystallography

Fourier syntheses providing electron density maps are usually affected by truncation effects due to the limited data resolution. A recent theoretical approach [Altomare, Cuocci, Giacovazzo, Kamel, Moliterni & Rizzi (2008). Acta Cryst. A 64 , 326–336] suggests that the resolution bias may be reduced by correcting t…

Crystallography and molecular interactionsEnzyme Structure and FunctionX-ray Diffraction in Crystallography

Iron Tetraanthracenotetraazaporphyrins: Synthesis, Structural Characterization, Ligand Binding Properties, and Unexpected Selectivity of a Bis-“Bowl” Tetraazaporphyrin

Jeffrey P. Fitzgerald、Joshua R. Lebenson、Guangbin Wang 等 6 位作者2008-05-07Inorganic Chemistry

The synthesis and characterization, by optical spectroscopy, mass spectrometry, superconducting quantum interference device (SQUID) magnetometry, and single-crystal X-ray diffraction, of six iron complexes of tetraanthracenotetraazaporphyrin (TATAP) are reported. Eight benzo groups, flanking the macrocycle periphery,…

Porphyrin and Phthalocyanine ChemistryHeme Oxygenase-1 and Carbon MonoxideHemoglobin structure and function

Reinforced Elastomers: From Molecular Physics to Industrial Applications

Gert Heinrich、Manfred Klüppel、Thomas A. Vilgis2008-05-07OpenAlex

This chapter demonstrates how a model of reinforced elastomers in its state allows a thorough description of the large-strain materials behavior of reinforced rubbers in several fields of technical applications. It presents a thoroughgoing line from molecular mechanisms to industrial applications of reinforced elastom…

Polymer Nanocomposites and PropertiesPolymer composites and self-healingSilicone and Siloxane Chemistry

Photochemically Induced Nucleation of Ribonuclease A Enhanced by a Stable Protein Dimer Produced from the Photochemical Reaction of Tyr Residual Groups

Kenji Furuta、Hiroaki Horiuchi、Hiroshi Hiratsuka 等 4 位作者2008-05-07Crystal Growth & Design

We demonstrated the photochemically induced nucleation of ribonuclease A (RNaseA), which lacks Trp residual groups. We have reported the photochemically induced nucleation of the hen egg-white lysozyme and the thaumatin systems, where photochemically induced nucleation brought about the photochemical reaction of the T…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Thermoplastic Elastomers

Francis Reny Costa、Naba K. Dutta、Namita Roy Choudhury 等 4 位作者2008-05-07OpenAlex

The emergence of thermoplastic elastomers (TPEs) provided a new horizon to the field of polymer technology. TPEs bridge the gap between conventional rubbers and thermoplastics. The hard segments that act as physical cross-links are thermally labile, and this allows TPEs to soften and flow under shear force at elevated…

Polymer Nanocomposites and PropertiesSilicone and Siloxane Chemistry

Effects of Carboxyl Content on the Characteristics of TMP Long Fibers

Lianshan Mao、Kwei-Nam Law、Claude Daneault 等 4 位作者2008-05-07Industrial & Engineering Chemistry Research

This work examined the effects of carboxyl content on the characteristics of TMP long fibers. The carboxyl groups on TMP long fibers were generated by a TEMPO-mediated oxidation using different amounts of sodium hypochlorite. In general, the increases in carboxyl content improved the tensile and burst indices but redu…

Surface Modification and SuperhydrophobicityAdvanced Cellulose Research StudiesElectrospun Nanofibers in Biomedical Applications

Solubility of 11β-Hydroxypregna-1,4,16-triene-3,20-dione in Different Solvents

Qiaoli Chen、Yongli Wang、Xiao-Hong Wu 等 4 位作者2008-05-07Journal of Chemical & Engineering Data

Using a laser monitoring observation technique, the solubilities of 11β-hydroxypregna-1,4,16-triene-3,20-dione in ethanol, acetone, and ethanol + water were determined by the synthetic method. The experimental data can be well correlated by the Apelblat equation (for the ethanol and acetone pure solvent system) or the…

Analytical Chemistry and ChromatographyCrystallization and Solubility StudiesChemical and Physical Properties in Aqueous Solutions

EFFECT OF OLIVE OIL AND GLYCEROL ON PHYSICAL PROPERTIES OF WHEY PROTEIN CONCENTRATE FILMS

Majid Javanmard、Leila Golestan2008-05-07Journal of Food Process Engineering

ABSTRACT Olive oil was incorporated into whey protein through emulsification to produce films. Whey protein films were prepared by dispersing 10% protein in distilled water; and plasticized with different levels of glycerol (glycerol : protein [Gly : pro ] = 0.5 and 0.6). Olive oil was added at different levels (oil :…

Postharvest Quality and Shelf Life ManagementNanocomposite Films for Food Packaging

Offene Gerüststrukturen von Übergangsmetallen

Srinivasan Natarajan、Sukhendu Mandal2008-05-07Angewandte Chemie

Abstract In den letzten Jahren hat sich gezeigt, dass neben anorganischen Silicaten und Phosphaten auch Carboxylate, Arsenate, Sulfate, Selenate, Selenite, Germanate und Phosphite offene Gerüststrukturen bilden können. Von besonderem Interesse sind die organisch‐anorganischen Hybridverbindungen, die sich aus der Kombi…

Metal-Organic Frameworks: Synthesis and ApplicationsMagnetism in coordination complexesInorganic Chemistry and Materials

Nanostructured Micellar Films Formed via Layer-by-Layer Deposition of Photoactive Polymer

Szczepan Zapotoczny、Monika Golonka、Maria Nowakowska2008-05-07Langmuir

Photoactive nanostructured micellar films were prepared from the amphiphilic copolymer poly(sodium styrenesulfonate- stat-2-vinylnaphthalene) (PSSS- stat-VN) and cationic polyelectrolyte poly(diallyldimethylammonium chloride) (PDADMAC) or poly(allylamine hydrochloride) (PAH) on quartz and silicon substrates via layer-…

Quantum Dots Synthesis And PropertiesPolymer Surface Interaction StudiesMolecular Junctions and Nanostructures

Influence of the film thickness on the structure, optical and electrical properties of ITO coatings deposited by sputtering at room temperature on glass and plastic substrates

C. Guillén、J. Herrero2008-05-07Semiconductor Science and Technology

Transparent and conductive indium tin oxide (ITO) films with thickness between 0.2 and 0.7 µm were deposited by sputtering at room temperature on glass and polyethylene terephthalate (PET) substrates. All films were polycrystalline, with crystallite size increasing and lattice distortion decreasing when the film thick…

ZnO doping and propertiesThin-Film Transistor TechnologiesTransition Metal Oxide Nanomaterials

Magneto-optical study of the spin-polarized electronic states in multiferroicTbMnO3

M. Bastjan、S. G. Singer、G. Neuber 等 8 位作者2008-05-07Physical Review B

The magnetic and electronic properties of multiferroic $\mathrm{Tb}\mathrm{Mn}{\mathrm{O}}_{3}$ in the paramagnetic, antiferromagnetic, sinusoidal, and spiral-spin phases were studied by spectral generalized magneto-optical ellipsometry. The measurements show a strong anisotropy of the dielectric tensor. A redistribut…

Ferroelectric and Piezoelectric MaterialsMagnetic and transport properties of perovskites and related materialsMultiferroics and related materials

Structure–property co‐relationship of fluorinated poly(imide‐siloxane)s

Anindita Ghosh、Susanta Banerjee2008-05-07Polymers for Advanced Technologies

Abstract Eight poly(imide‐siloxane)s co‐polymers have been prepared by one pot solution imidization method. The polymers are synthesized by the reaction of bisphenol‐A‐dianhydride (BPADA) with fluorinated diamine 4,4′‐bis(3″‐trifluoromethyl‐ p ‐aminobiphenyl ether) biphenyl, and aminopropyl‐terminated polydimethylsilo…

Epoxy Resin Curing ProcessesSynthesis and properties of polymersSilicone and Siloxane Chemistry

Direct Synthesis, Crystal Structures, High-Field EPR, and Magnetic Studies of Heterometallic Polymers Containing Manganese(II) Carboxylates Interconnected by [Cu(en)2]2+

Valeriya G. Makhankova、A.O. Beznischenko、Vladimir N. Kokozay 等 7 位作者2008-05-07Inorganic Chemistry

Two heterometallic polymers containing cations [Cu(en)2]2+ and either the [Mn(mal)2(H2O)2]2- (1) or [Mn2(succ)2Cl2]n2n- (2) anions (mal=malonate and succ=succinate) were investigated by X-ray crystallography, high-field electron paramagnetic resonance (EPR) spectroscopy, and magnetic susceptibility measurements. Magne…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesElectron Spin Resonance Studies

Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties

Sabine Strobel、Amitava Choudhury、Peter K. Dorhout 等 5 位作者2008-05-07Inorganic Chemistry

The rare-earth metal(III) oxide selenides of the formula La4O4Se[Se2], Ce4O4Se[Se2], Pr4O4Se[Se2], Nd4O4Se[Se2], and Sm4O4Se[Se2] were synthesized from a mixture of the elements with selenium dioxide as the oxygen source at 750 degrees C. Single crystal X-ray diffraction was used to determine their crystal structures.…

Crystal Structures and PropertiesIron-based superconductors researchInorganic Chemistry and Materials

Synthesis of Palladium Nanobricks with Atomic-Step Defects

Akrajas Ali Umar、Munetaka Oyama2008-05-07Crystal Growth & Design

We demonstrate a facile method for the preparation of the Pd nanobricks (NBs) which comprise atomic-step defects on the nanocrystal surface. By simply controlling the reaction parameters including the cetyltrimethylammonium bromide (CTAB) to hexamethylenetetramine (HMT) ratio and the ascorbic acid concentration, we ca…

Gold and Silver Nanoparticles Synthesis and ApplicationsQuantum Dots Synthesis And PropertiesNanocluster Synthesis and Applications

Optical Fiber-Excited Surface Plasmon Resonance Spectroscopy of Single and Ensemble Gold Nanorods

Weihai Ni、Huanjun Chen、Xiaoshan Kou 等 5 位作者2008-05-07The Journal of Physical Chemistry C

Gold nanorods are deposited on the core surface of an etched optical fiber, and their surface plasmon resonance is excited by the evanescent wave from the optical fiber. The excitation of the surface plasmon produces strong light scattering from individual nanorods, allowing for single-particle scattering-based imagin…

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon ResearchBiosensors and Analytical Detection

Structure and function of window glass and Pyrex

J. C. Phillips、Richard Kerner2008-05-07The Journal of Chemical Physics

Window glass is a ternary mixture, while Pyrex (after window glass, the most common form of commercial glass) is a quaternary. Here, we investigate the chemical, physical, and mathematical factors that determine the compositions of these optimized glasses. Previously, we succeeded in deriving exactly the composition o…

Material Dynamics and PropertiesGlass properties and applicationsTheoretical and Computational Physics

Structural Phase Transitions in the Potential Hydrogen Storage Compound KBH4 under Compression

Ravhi S. Kumar、Eunja Kim、Andrew Cornelius2008-05-07The Journal of Physical Chemistry C

Angle-dispersive high-pressure powder X-ray diffraction, high-pressure Raman, and ab initio density functional theoretical (DFT) calculations were performed on KBH 4 up to 20 GPa. We demonstrate that KBH 4 exhibits structural phase transitions from the ambient α-KBH 4 phase (cubic F m 3̅ m ) to β-KBH 4 (tetragonal P 4…

High-pressure geophysics and materialsHydrogen Storage and MaterialsQuantum, superfluid, helium dynamics

Increase in the fracture toughness and bond energy of clay by a root exudate

Bo Zhang、Paul D. Hallett、Guangping Zhang2008-05-07European Journal of Soil Science

Summary Root exudates help drive the formation of the rhizosphere by binding soil particles, but the underlying physical mechanisms have not been quantified. This was addressed by measuring the impact of a major component of root exudates, polygalacturonic acid (PGA), on the interparticle bond energy and fracture toug…

Soil Carbon and Nitrogen DynamicsSoil and Unsaturated FlowClay minerals and soil interactions