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A theoretical study of lithium intercalation into V6O13—a combined classical, quantum mechanical approach

J. Spencer Braithwaite、C. Richard A. Catlow、John H. Harding 等 4 位作者2001-01-01Physical Chemistry Chemical Physics

A theoretical study of lithium intercalation into the transition metal oxide cathode material, V6O13, is presented. A combination of classical and quantum mechanical computational simulation techniques are used to predict the stable sites occupied by inserted lithium ions, changes to the unit cell dimensions as lithiu…

Advancements in Battery MaterialsSemiconductor materials and devicesTransition Metal Oxide Nanomaterials

Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA–; R = Me, Et, Prn, Bun)

S. Sekizaki、C. Tada、Hideki Yamochi 等 4 位作者2001-01-01Journal of Materials Chemistry

Eight cation radical salts of tetrathiotetracene (TTT) with a series of 2-alkoxytetracyanoallyl anions (RO-TCA−; R = Me, Et, Prn, Bun) were prepared by electrocrystallisation. All of them were non-magnetic semiconductors. Seven crystal structures were determined. The physical and structural aspects of the salts were w…

Magnetism in coordination complexesOrganic and Molecular Conductors ResearchSolid-state spectroscopy and crystallography

Acrylic acid-doped polyaniline sensitive to ammonia vapors

Anjali A. Athawale、Vasant Chabukswar2001-01-01Journal of Applied Polymer Science

Acrylic acid and HCl-doped polyanilines were synthesized by chemical oxidative polymerization. The synthesized materials were used as sensors for ammonia. Comparison of the responses of the two polymers reveal that the acrylic acid-doped polymer exhibits higher sensitivity and reversibility. Further, the resistance is…

Electrochemical sensors and biosensorsConducting polymers and applicationsAnalytical Chemistry and Sensors

Optically active molecule‐based magnets: Enantioselective self‐assembling, optical, and magnetic properties

Michel Gruselle、Román Andrés、B. Malézieux 等 6 位作者2001-01-01Chirality

In this short communication we describe the synthesis and the optical and magnetic properties of optically active three dimensional (3D) bimetallic [Cr-Mn] networks [[Delta Cr(III) Delta Mn(II)(ox)(3)][Delta Ru(II)(bpy)(3)]ClO(4)](n)1 - Delta, [[Lambda Cr(III)Lambda Mn(II)(ox)(3)][Lambda Ru(II) (bpy)(3)]ClO(4)](n) 1 -…

Magnetism in coordination complexesPorphyrin and Phthalocyanine ChemistryOrganic and Molecular Conductors Research

Degradation of Impact Toughness due to Formation of R Phase in High Nitrogen 25Cr-7Ni-Mo Duplex Stainless Steels.

Jie Cui、In‐Sung Park、Chang-Yong Kang 等 4 位作者2001-01-01ISIJ International

Influences of the formation behavior of the R phase on the hardness and the impact toughness were experimentally studied for high nitrogen duplex stainless steels containing 25 mass% of Cr, 7 mass% of Ni, 3 to 5 mass% of Mo, 0.14 to 0.27 mass% of N, and 0.02 mass% of C. The steels were solution heat treated at 1 323 K…

Microstructure and Mechanical Properties of SteelsFatigue and fracture mechanicsHydrogen embrittlement and corrosion behaviors in metals

Structure development in oriented polyethylene films and microporous membranes as monitored by sound propagation

M. Raab、J. udla、Alexander G. Kozlov 等 5 位作者2001-01-01Journal of Applied Polymer Science

Microporous membranes of high-density polyethylene were prepared by melt-extrusion followed by annealing and uniaxial extension. Crystallization at a high melt flow rate and subsequent annealing of the spun films with fixed ends led to the formation of oriented hard-elastic materials with a high modulus of elasticity…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesNatural Fiber Reinforced Composites

Effective Thermal Conductivity and Thermal Contact Conductance of Graphite Fiber Composites

S. Mirmira、Marian C. Jackson、L. S. Fletcher2001-01-01Journal of Thermophysics and Heat Transfer

The transverse and longitudinal effective thermal conductivity and contact conductance of discontinuous and misoriented graphite fiber-reinforced composites has been studied over a range of temperatures (20-200°C) and pressures (172-1720 kPa). Three different fiber types (DKE X, DKA X, and K22XX) and three fiber volum…

Thermal properties of materialsComposite Material MechanicsFiber-reinforced polymer composites

Review : Current international research into cellulosic fibres and composites

S.J. Eichhorn、C.A. Baillie、N. Zafeiropoulos 等 14 位作者2001-01-01OpenAlex

Abstract This paper provides an overview of recent progress made in the area of cellulose nanofibre-based nanocomposites. An introduction into the methods used to isolate cellulose nanofibres (nanowhiskers, nanofibrils) is given, with details of their structure. Following this, the article is split into sections deali…

Natural Fiber Reinforced CompositesTextile materials and evaluationsArchitecture and Computational Design

Ecology of freshwater diatoms from the central region of Portugal

Salomé F.P. Almeida、Maria Candida P Gil2001-01-01Cryptogamie Algologie

Des echantillons de diatomees tychoplanctoniques et epilithiques ont ete preleves tous les mois pendant une annee sur 18 stations dans le cours inferieur de quelques fleuves et rivieres de la region nord-centre du Portugal. L'analyse canonique des correspondances a ete utilisee pour examiner les relations entre les va…

Aquatic Ecosystems and Phytoplankton DynamicsDiatoms and Algae ResearchAquatic Invertebrate Ecology and Behavior

New segmented poly(ester-urethane)s from renewable resources

Yan Liu、Margaretha S�derqvist Lindblad、Elisabetta Ranucci 等 4 位作者2001-01-01Journal of Polymer Science Part A Polymer Chemistry

The physical and mechanical properties of aliphatic homopolyesters from monomers obtainable from renewable resources, namely, 1,3-propanediol and succinic acid, were improved by their combination with aromatic urethane segments capable of establishing strong intermolecular hydrogen bonds. Segmented poly(ester-urethane…

biodegradable polymer synthesis and propertiesPolymer composites and self-healingCarbon dioxide utilization in catalysis

Tissue adhesive using synthetic model adhesive proteins inspired by the marine mussel

Hideki Tatehata、Akira Mochizuki、Kousaku Ohkawa 等 5 位作者2001-01-01Journal of Adhesion Science and Technology

The surface free energy and its dispersion and polar components of pigskin were determined by wettability measurements. The contact angles and work of adhesion of solutions of the synthetic model adhesive sequence poly(Gly-Tyr-Lys) inspired by marine adhesive proteins were measured on the epidermis and the dermis of p…

Surface Modification and SuperhydrophobicityPolymer Surface Interaction StudiesCollagen: Extraction and Characterization

A continuous wave and pulse electron paramagnetic resonance study of Co(II) (tetraphenylporphyrin) in different matrices

Sabine Van Doorslaer、Arthur Schweiger2001-01-01Physical Chemistry Chemical Physics

The knowledge of the exact electronic structure of Co(II) porphyrins is important in view of their interest as models for the prosthetic groups in proteins and in view of their use as catalysts. Here, we present a continuous wave and pulse electron paramagnetic resonance (EPR) study of CoTPP (5,10,15,20-tetraphenyl-21…

Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesElectron Spin Resonance Studies

Crystal structure of the thallium strontium cobaltite TlSr2CoO5 and its relationship to the electronic properties

Jean‐Pierre Doumerc、Martine Coutanceau、Alain Demourgues 等 6 位作者2001-01-01Journal of Materials Chemistry

The complex cobaltite TlSr2CoO5 undergoes a first-order metal–insulator phase transition at room temperature. The structures of the high temperature (HT) and low temperature (LT) phases have been refined on powder samples using electron diffraction, X-ray diffraction and EXAFS. The HT-phase is isostructural with the s…

Magnetic and transport properties of perovskites and related materialsRare-earth and actinide compoundsAdvanced Condensed Matter Physics

Structural and Thermodynamic Behavior of Eukaryotic Initiation Factor 4E in Supramolecular Formation with 4E-Binding Protein 1 and mRNA Cap Analogue, Studied by Spectroscopic Methods.

Xu Shen、Koji Tomoo、Susumu Uchiyama 等 5 位作者2001-01-01Chemical and Pharmaceutical Bulletin

The structural and thermodynamic behavior of the complex formation of eIF4E with either or both mRNA cap analogue (m7GTP, m7GpppA, or m7GpppG) and 4EBP1 has been investigated by spectroscopic measurements. Although the circular dichroism (CD) spectrum of eIF4E was little affected by the association with any cap analog…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Effect of Metal Ions on the Degradation and Adsorption of Two Cellobiohydrolases on Microcrystalline Cellulose

Dong‐Won Kim、Yeong Heon Jang、Chang Seok Kim 等 4 位作者2001-01-01Bulletin of the Korean Chemical Society

Ba ++ , Pb ++ , and Cd ++ . The addition of Mn ++ , Ba ++ , and Ca ++ (10 mM) during the hydrolysis of Avicel PH 101 caused an increase in the total reducing sugar (TRS) for CBH I by 142, 135, and 114 percent, respectively. Those for CBH II increased by 177, 175, and 115 percent, respectively. The Mn ++ was the most s…

Biofuel production and bioconversionAdvanced Cellulose Research StudiesPolysaccharides and Plant Cell Walls

Poli(Álcool Vinílico) Modificado com Cadeias Hidrocarbônicas: Avaliação do Balanço Hidrófilo/Lipófilo

Isabele B. Aranha、Elizabete F. Lucas2001-01-01Polímeros

Terpolímeros de poli(álcool vinílico) foram sintetizados por meio de reação de esterificação do PVA parcialmente hidrolisado com cloretos de ácidos graxos de comprimento de cadeia diferentes. O objetivo da síntese foi obter polímeros à base de PVA com pequenas variações no balanço hidrófilo/lipófilo e nas propriedades…

biodegradable polymer synthesis and properties

Inorganic–organic hybrids by exfoliation of MoS2

Anthony V. Powell、Laura Kosidowski、Andrew McDowall2001-01-01Journal of Materials Chemistry

A range of electron-rich organic molecules has been intercalated into MoS2 by the method of exfoliation–reflocculation. Intercalation produces an expansion of the lattice in a direction perpendicular to the dichalcogenide layers, the magnitude of which suggests that in the majority of cases, the guest adopts an orient…

2D Materials and ApplicationsCorrosion Behavior and InhibitionPolyoxometalates: Synthesis and Applications

DNA binding studies of cationic lanthanide complexes bearing a phenanthridinium group

Gabriella Bobba、Suzanna D. Kean、David Parker 等 5 位作者2001-01-01Journal of the Chemical Society Perkin Transactions 2

The binding of tetracationic Λ- and Δ-europium complexes of tetraamide and triamide ligands incorporating an N-methylphenanthridinium group to calf-thymus DNA, poly(dGdC) and super-coiled plasmid DNA has been monitored by absorption, luminescence and CD difference spectroscopy. With the tetraamide complexes, preferent…

Metal complexes synthesis and propertiesDNA and Nucleic Acid ChemistryLanthanide and Transition Metal Complexes

Synthesis of Pyrene Containing Building Blocks for Dendrimer Synthesis

Claudia Modrakowski、Silvia Camacho Flores、Matthias Beinhoff 等 4 位作者2001-01-01Synthesis

Efficient syntheses of the novel, pyrene containing branched building blocks 10, 13, 22, 25 and of a pyrene based core molecule 16 for the construction of dendrimers are reported. The main tool is a Suzuki cross-coupling. The functional groups for further growth are amines and carboxylic acids, which were used in an o…

Advanced Polymer Synthesis and CharacterizationDendrimers and Hyperbranched PolymersSynthesis and properties of polymers

Spectroscopy of natural silica-rich glasses.

E. Faulques、Emmanuel Fritsch、Mikhail Ostroumov2001-01-01Journal of Mineralogical and Petrological Sciences

Natural-silica-rich glasses (impactites, tektites and obsidians) have been investigated with infrared (IR), Raman and optical spectroscopy. Comparison with artificial glasses with silica-rich and alkali-rich compositions is made. The vibrational data of these compounds are discussed in relationship with their structur…

Geological and Geochemical AnalysisGlass properties and applicationsMineralogy and Gemology Studies