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Calculation of the second-order electronic polarizabilities of some organic molecules. Part 1

Vincent J. Docherty、David Pugh、John Morley1985-01-01Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics

A version of the CNDO/S method has been re-parametrized by correlating computed and measured dipole moments and transition wavelengths for a range of organic conjugated molecules. The method has then been used to calculate the hyperpolarizability tensor, βijk, in the form related to second-harmonic generation, for an…

Nonlinear Optical Materials ResearchPhotochemistry and Electron Transfer StudiesSpectroscopy and Quantum Chemical Studies

Roles of Organic Matter in Sediment Diagenesis

作者信息未提供1985-01-01SEPM (Society for Sedimentary Geology) eBooks

Abstract This volume is the direct result of an SEPM Research Conference held in October 1983 at Lost Valley Ranch, Colorado. The goal of the volume is to bring attention of the sedimentological community the importance of interaction of organic compounds with the inorganic sedimentary system and the degree to which o…

Hydrocarbon exploration and reservoir analysisRadioactive element chemistry and processingDiatoms and Algae Research

6-dimensional properties of Al0.86Mn0.14 alloy

Pavel Kalugin、A. Yu. Kitayev、Leonid Levitov1985-01-01Journal de Physique Lettres

The general properties of the phases with the icosahedral point group and long-range orientational order are considered. 6 Goldstone modes — 3 phonons and 3 phasons — are shown to exist. A model for the microscopic structure — a 6-D crystal — is proposed, and phason modes are discussed in this framework. Bravais latti…

Aluminum Alloy Microstructure PropertiesQuasicrystal Structures and PropertiesX-ray Diffraction in Crystallography

Cholesteric to cholesteric phase transitions in liquid crystals

Helmut R. Brand、Harald Pleiner1985-01-01Journal de Physique Lettres

We discuss the phase transitions which can occur between two different cholesteric phases and we present general symmetry arguments why this transition has to be always of the first order. We derive the macroscopic dynamics close to the phase transition and we propose an experiment to shift the critical temperature wh…

Liquid Crystal Research AdvancementsLipid Membrane Structure and BehaviorNonlinear Dynamics and Pattern Formation

Weighted least squares estimation of background in EELS imaging

Thierry Pun、James Ellis、Murray Eden1985-01-01Journal of Microscopy

In quantitative Electron Energy Loss Spectrometry, a weighted least squares estimation should theoretically be used to estimate the background law below core edge energy, since the variances of the data vary. However, it is found that proper weighting makes the above edge signal-to-noise ratio decrease rather than inc…

X-ray Spectroscopy and Fluorescence AnalysisNuclear Physics and ApplicationsElectron and X-Ray Spectroscopy Techniques

Methods for increasing drilling performance of the thermal spallation drilling system

Thomas Dey、Robert L. Kranz1985-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Current thermal spallation drilling methods offer advantages in performance and cost over conventional rotary methods. We have analyzed the mechanics of the thermal spallation process and found that heat transfer from the hot gases to the rock is the key process for limiting better penetration rates. Increasing the op…

Drilling and Well EngineeringNuclear Materials and PropertiesTunneling and Rock Mechanics

Notch sensitivity of graphite materials for VHTR.

Haruo Kawakami1985-01-01Journal of the Atomic Energy Society of Japan / Atomic Energy Society of Japan

Notch effects on strength were investigated for IG-11 and PGX graphite, which were promising materials for core structures of an experimental VHTR in Japan. Notch sensitivity in tensile strength tests decreased as notch radius decreased. Notch sensitivity of IG-11 was higher than that of PGX. Compressive fracturse of…

Fatigue and fracture mechanicsGraphite, nuclear technology, radiation studiesNuclear and radioactivity studies

Les sources thermales de Prony (Nouvelle-Calédonie) et leurs précipités chimiques. Exemple de formation de brucite primaire

Jean Claude Launay、J.Ch. Fontes1985-01-01OpenAlex

In the Prony Bay (S.E. New Caledonia) there are many terrestrial and submarine thermal springs. Their chemistry is particularly noti- ccable since pH is still equal to 11 and caused by the only presence of ions OH- without any carbonate or bicarbonate. The cations are calcium and potassium. On ground, the thermal wate…

Paleontology and Stratigraphy of FossilsClay minerals and soil interactionsChemical Synthesis and Characterization

The mesophase in carbonaceous pitches

L.S. Singer1985-01-01Faraday Discussions of the Chemical Society

An intermediate nematic mesophase state has been found to occur in carbonaceous pitches during their thermal transformation to coke and carbon. The molecules responsible for mesophase formation are, by and large, disc-like and mostly aromatic, and their distribution of molecular weights is quite critical. The liquid c…

Liquid Crystal Research AdvancementsSynthesis and Properties of Aromatic CompoundsMolecular spectroscopy and chirality

Contact Angle Equilibrium on Thin Elastic Solids

Martin E. R. Shanahan1985-01-01The Journal of Adhesion

A theoretical analysis has been carried out on the system consisting of an axisymmetric sessile drop resting on a thin elastic solid in the presence of gravity. The solid is treated in one case as a thin plate and in the other case as a membrane. The consequences of the variational treatment employed are equations rel…

Surface Modification and SuperhydrophobicityAdvanced Sensor and Energy Harvesting MaterialsAdhesion, Friction, and Surface Interactions

On the Calculation of Aerodynamic Diameters of Fibers

Igor Gonda、Ahmed Farid Abd El Khalik1985-01-01Aerosol Science and Technology

This paper is restricted to the theoretical expressions for calculation of the aerodynamic diameters of fibers based on the viscous drag of prolate spheroids. The volume of the fibers is calculated either by the expression for a cylinder (Harris and Fraser, 1976) or the expression for a prolate spheroid (Khalik and Go…

Textile materials and evaluationsAerosol Filtration and Electrostatic Precipitation

Strengthening Mechanisms in Al–Li Alloys Containing Coherent Ordered Particles

Minoru Furukawa、Yasuhiro Miura、Minoru Nemoto1985-01-01Transactions of the Japan Institute of Metals

Strength of Al–Li alloys containing Ll2 ordered δ′-particles have been discussed on the basis of observed behavior of dislocations, taking into account various resistances to dislocation motion in the alloys. The measured yield strength and the observed arrangements of deformation induced dislocations are successfuly…

Microstructure and mechanical propertiesAluminum Alloy Microstructure PropertiesHigh Temperature Alloys and Creep

Reaction of Epichlorhydrin with Carbohydrate Polymers. Part II. Starch Reaction Mechanism and Physicochemical Properties of Modified Starch

K. P. Ravindranathan Kartha、H. C. Srivastava1985-01-01Starch - Stärke

Abstract Detailed mechanistic pathways are described for starch‐epichlorohydrin (ECH) reaction. The mature and extent of side reactions accompanying the cross‐linking reaction as well as the influence of reaction conditions on these have been demonstrated. The influence of degree of crosslinking of starch on its vario…

Food composition and propertiesHydrogels: synthesis, properties, applicationsbiodegradable polymer synthesis and properties

Dynamic Behaviour of Active Sites of a SiO2-Attached Mo(VI)-Dimer Catalyst during Ethanol Oxidation Observed by Means of EXAFS

Yoshio Iwasawa、Kiyotaka Asakura、Hisao Ishii 等 4 位作者1985-01-01Zeitschrift für Physikalische Chemie

Article Dynamic Behaviour of Active Sites of a SiO2-Attached Mo(VI)-Dimer Catalyst during Ethanol Oxidation Observed by Means of EXAFS was published on January 1, 1985 in the journal Zeitschrift für Physikalische Chemie (volume 144, issue 144).

Magnetism in coordination complexesAdvanced Electron Microscopy Techniques and ApplicationsIron oxide chemistry and applications

The Formation of Filamentous Carbon on iron and Nickel Catalysts

E. Boellaard、Prithwiraj De、A.J.H.M. Kock 等 4 位作者1985-01-01OpenAlex

The microstructure of primary carbon filaments formed on supported iron and nickel catalysts has been investigated using transmission electron microscopy, dark-held imaging, and (selectedarea) electron diffraction. It has been established that the filaments consist of cone-shaped graphite layers, stacked with their c-…

Carbon Nanotubes in CompositesAdvanced Physical and Chemical Molecular InteractionsChemical and Physical Properties of Materials

Growth rate dispersion in MSMPR crystallizers

M. A. Larson、Edward T. White、K. A. Ramanarayanan 等 4 位作者1985-01-01AIChE Journal

Abstract A model is presented which relates the crystal size distribution (CSD) from a mixed–suspension, mixed‐product‐removal (MSMPR) crystallizer to the distribution of growth rates. This model is based on the assumption that individual contact nuclei have some inherent growth rate which remains constant, but the gr…

Calcium Carbonate Crystallization and InhibitionCrystallization and Solubility StudiesFreezing and Crystallization Processes

The crystal structure of arsenic selenide, As2Se3

A. C. Stergiou、P. J. Rentzeperis1985-01-01Zeitschrift für Kristallographie

Single crystals of As 2 Se 3 were prepared hydrothermally. The crystal structure was determined by using the intensities of 1014 independent reflections, measured on a computer-controlled single-crystal diffractometer. The cell constants, refined by least-squares, are: a = 12.0774(4), b = 9.9037(6), c = 4.2835(6) Å, β…

Chalcogenide Semiconductor Thin FilmsCrystal Structures and PropertiesPhase-change materials and chalcogenides

Voltammetric studies on a glassy carbon electrode. Part II. Factors influencing the simple electron-transfer reactions—the K 3 [Fe(CN) 6 ]-K 4 [Fe(CN) 6 ] system

Michael Noel、P. N. Anantharaman1985-01-01The Analyst

Detailed cyclic voltammetric studies were carried out on the hexacyanoferrate(II)-hexacyanoferrate(III) redox system in H2SO4, Na2SO4, NaOH, NaCl, KCl, NaH2PO4, Na2C2O4 and trisodium citrate media on a glassy carbon electrode. The effects of polishing and cleaning, chemical and electrochemical surface treatments, pH,…

Conducting polymers and applicationsElectrochemical Analysis and ApplicationsAnalytical Chemistry and Sensors

Ion exchange of K 4 Nb 6 O 17 ·3H 2 O

Nobukazu Kinomura、Nobuhiro Kumada、Fumio Muto1985-01-01Journal of the Chemical Society Dalton Transactions

Ion exchange of the layered compound K4Nb6O17·3H2O with mono- and bi-valent cations (Li+, Na+, Ca2+, and Ni2+) has been carried out in the aqueous chloride solutions at 90 °C. Only Na+ was found to attain to complete exchange. For exchange with Li+, almost all the K+ ions in the interlayers seemed to be replaced, alth…

Polyoxometalates: Synthesis and ApplicationsLayered Double Hydroxides Synthesis and ApplicationsChemical Synthesis and Characterization