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Chemical reaction coordinates from crystal structure data. I.

Hans Beat Buergi1973-10-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTChemical reaction coordinates from crystal structure data. I.H. B. BuergiCite this: Inorg. Chem. 1973, 12, 10, 2321–2325Publication Date (Print):October 1, 1973Publication History Published online1 May 2002Published inissue 1 October 1973https://pubs.acs.org/doi/10.1021/ic50…

Analytical Chemistry and ChromatographyVarious Chemistry Research TopicsCrystallization and Solubility Studies

A powder-diagram automatic-indexing routine

D. Taupin1973-10-01Journal of Applied Crystallography

The program presented here performs an automatic indexing of powder patterns by means of a trial-and-error method. It has been optimized and presents a good flexibility. It can account for various additional information, known a priori. In addition, extensive error computations are included in it, leading to a good re…

Thermal and Kinetic AnalysisCrystallization and Solubility StudiesPowder Metallurgy Techniques and Materials

Metal complexes of 1,4,8,11-tetramethyl-1,4,8,11-tetraazacyclotetradecane, N-tetramethylcyclam

E. Kent Barefield、Frank S. Wagner1973-10-01Inorganic Chemistry

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTMetal complexes of 1,4,8,11-tetramethyl-1,4,8,11-tetraazacyclotetradecane, N-tetramethylcyclamE. Kent Barefield and Frank WagnerCite this: Inorg. Chem. 1973, 12, 10, 2435–2439Publication Date (Print):October 1, 1973Publication History Published online1 May 2002Published inis…

Metal complexes synthesis and propertiesMagnetism in coordination complexesLanthanide and Transition Metal Complexes

Nylon 6 fibers: Changes in structure between moderate and high draw ratios

D. C. Prevoršek、P. J. Harget、Abhishek Sharma 等 4 位作者1973-10-01Journal of Macromolecular Science Part B

The in-phase modulus and coefficient of diffusion of nylon 6 fibers are analyzed in terms of wide-and small-angle X-ray diffraction data. Both properties are examined in directions parallel and perpendicular to the fiber axis. The anisotropy in diffusion and mechanical coupling between the crystalline and amorphous ph…

Polymer crystallization and propertiesComposite Material MechanicsPolymer Nanocomposites and Properties

Frank Elastic Constants of the Hard-Rod Liquid Crystal

Joseph P. Straley1973-10-01Physical Review A

The elastic constants of a hard-rod liquid crystal are calculated using the Onsager theory, with results similar to those given by Priest.Received 30 April 1973DOI:https://doi.org/10.1103/PhysRevA.8.2181©1973 American Physical Society

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesAdvanced Materials and Mechanics

Acidic properties of Binary Metal Oxides

Katsue Shibata、Tadamitsu Kiyoura、Jun Kitagawa 等 5 位作者1973-10-01Bulletin of the Chemical Society of Japan

Abstract Eighteen binary metal oxides consisting of TiO2–MmOn, ZnO–MmOn and Al2O3–MmOn (MmOn: metal oxide) were prepared by the usual co-precipitation method, their acid amounts and strengths being determined by n-butylamine titration using various acid-base indicators. The acid strengths of fourteen of the tested bin…

Catalytic Processes in Materials ScienceThermal and Kinetic AnalysisCatalysis and Hydrodesulfurization Studies

Simple Molecular Theory of the SmecticCPhase

W. L. McMillan1973-10-01Physical Review A

A physical picture of the smectic $C$ phase is proposed in which the molecules rotate freely about their long axes in the smectic $A$ phase and this rotation is frozen out in the smectic $C$ phase. This picture is in contrast with the accepted view that the long axis of the molecules is normal to the smectic planes in…

Liquid Crystal Research AdvancementsPhotonic Crystals and ApplicationsMolecular spectroscopy and chirality

Tafel Slopes and Corrosion Rates from Polarization Resistance Measurements

F. Mansfeld1973-10-01CORROSION

A new analysis of polarization curves in the non-Tafel region in the vicinity of the corrosion potential is described which allows calculation of the polarization resistance (Rp) and the Tafel slopes (ba and bc). From these data instantaneous corrosion rates are calculated. Experimental data for the system Fe/1N H2SO4…

Corrosion Behavior and InhibitionConcrete Corrosion and DurabilityNon-Destructive Testing Techniques

Critical Behavior of Magnets with Dipolar Interactions. I. Renormalization Group near Four Dimensions

Amnon Aharony、Michael E. Fisher1973-10-01Physical review. B, Solid state

The exact renormalization-group approach of Wilson is used to study the critical behavior for $T>{T}_{c}$, $H=0$, and small $\ensuremath{\epsilon}>0$, of an isotropic ferromagnetic system in $d=4\ensuremath{-}\ensuremath{\epsilon}$ dimensions, with exchange and dipolar interactions between $d$-component spins. N…

Magnetism in coordination complexesPhysics of Superconductivity and MagnetismMagnetic properties of thin films

Hydrophilic Support Films of Controlled Thickness and Composition

Kenneth A. Taylor、Robert M. Glaeser1973-10-01Review of Scientific Instruments

A method is described for producing thin, hydrophilic support films for electron microscopy. These films have a well defined composition and can be made as thin as 10–15 Å. An application is described in which these hydrophilic films are used as ultrathin ``windows'' for frozen, aqueous specimens.

Advanced Electron Microscopy Techniques and ApplicationsAnodic Oxide Films and NanostructuresElectron and X-Ray Spectroscopy Techniques

Luminescence Centers of Ca(S : Se) Phosphors Activated with Impurity Ions Having s2 Configuration. I. Ca(S : Se) : Sb3+ Phosphors

Nobuhiko Yamashita1973-10-01Journal of the Physical Society of Japan

The emission, excitation and reflection spectra at 300, 80 and 15 K were obtained. The blue emission at 442 mµ was observed for CaS:Sb 3+ as well as the well-known yellow-green emission at 540 mµ. In the excitation or reflection spectra, A , B and C bands were found for all phosphors of Ca(S:Se):Sb 3+ investigated. Th…

Luminescence Properties of Advanced MaterialsRadiation Detection and Scintillator TechnologiesSolid-state spectroscopy and crystallography

Defect structure and electronic donor levels in stannic oxide crystals

Sherry D. Samson、Clifton G. Fonstad1973-10-01OpenAlex

By measuring the conductivity of stannic oxide crystals as a function of oxygen partial pressure at elevated temperatures, it is shown that the dominant native defect in SnO2 is a doubly ionizable oxygen vacancy. Both donor levels of this defect, the first 30 meV deep and the second 150 meV deep, are identified and a…

Electronic and Structural Properties of OxidesGas Sensing Nanomaterials and SensorsAdvancements in Solid Oxide Fuel Cells

The reversibility of the reaction CaCO3 ⇄ CaO+CO2

Ronald Barker1973-10-01OpenAlex

Abstract The reversibility of the reaction CaCO 3 ⇌ CaO+CO 2 has been examined through a large number of cycles (up to 40), mainly at 866 °C. The decomposition to the oxide is always 100% but the reactivity of the oxide so formed to carbon dioxide falls off markedly after a rapid initial reaction. There is a large inc…

Calcium Carbonate Crystallization and InhibitionZeolite Catalysis and SynthesisMethane Hydrates and Related Phenomena

Extension of theory of growth of chain-folded polymer crystals to large undercoolings

John I. Lauritzen、John Hoffman1973-10-01OpenAlex

The kinetic theory of the rate of growth G and the initial lamellar thickness lg* of chain-folded crystals is extended so that it is applicable at high undercoolings. Attention is centered on the details of how the first step element and the first fold are put down on the substrate. A parameter φ that varies between z…

Rheology and Fluid Dynamics StudiesPolymer Nanocomposites and PropertiesPolymer crystallization and properties

A theory for the low-temperature plastic deformation of glassy polymers

A. S. Argon1973-10-01OpenAlex

A theory of yielding of glassy polymers by thermally-activated production of local molecular kinks is described. It is possible to obtain the activation free enthalpy of this process by modeling the intermolecular energy barrier as resulting from the stress fields of two equal and opposite closely spaced wedge disclin…

Synthesis and properties of polymersPolymer Nanocomposites and PropertiesPolymer crystallization and properties

Stresses of hexagonal screw dislocation arrays. v. short range stresses and their contribution to latent hardening

M.N. Bassim、D. Kuhlmann‐Wilsdorf1973-09-16physica status solidi (a)

The short-range stresses of the hexagonal screw dislocation boundary, of the straight tilt boundary, and of a zig-zag tilt boundary are computed. These are found to be quite complicated geometrically. They are of comparable magnitude in all three cases but smaller for the straight tilt boundary than for the zig-zag bo…

High Temperature Alloys and CreepMicrostructure and mechanical propertiesMechanical stress and fatigue analysis

Some optical properties of tantalum borate (tabo4), a compound with unusual coordinations

G. Blasse、G.P.M. van den Heuvel1973-09-16physica status solidi (a)

Tantalum borate (TaBO4) has the zircon structure with unusual coordination for the cations: Ta5+ in eight- and B3+ in four-coordination. The infrared and Raman spectrum is reported and discussed. The symmetrical and asymmetrical BO5−4 valence stretching lies at much lower energy than usually observed in borates. A com…

Crystal Structures and PropertiesLuminescence Properties of Advanced MaterialsGlass properties and applications

The orientation relationship between the α- and ω-phases of titanium and zirconium

M. P. Usikov、V.A. Zil'bershtein1973-09-16physica status solidi (a)

High-pressure treated titanium and zirconium have been investigated by means of transmission electron microscopy. The specimens consisted mainly of retained ω-phase, while in some regions α-phase platelets were observed. Two crystallographically nonequivalent sets of matrices of correspondence between the α- and ω-pha…

Advanced materials and compositesIntermetallics and Advanced Alloy PropertiesTitanium Alloys Microstructure and Properties

Temperature Dependence of Second-Order Raman Scattering in Potassium and Rubidium Halides

J. E. Potts、Charles Walker、Indira R. Nair1973-09-15Physical review. B, Solid state

The second-order Raman-scattering spectra of KCl, KBr, KI, RbCl, RbBr, and RbI have been recorded at 300, 90, and 23 K. A symmetry analysis for reducing phonon pairs into irreducible representations has been employed, in conjuction with a knowledge of the one-phonon densities of states derived from neutron-diffraction…

Glass properties and applicationsLuminescence Properties of Advanced MaterialsSolid-state spectroscopy and crystallography

Screening of metal film defects by current noise measurements

J. L. Vossen1973-09-15Applied Physics Letters

Current noise measurements at high current densities have been applied to the detection of constrictions in thin-film metallization. Potentially open metal films due to scratches, notching, improper step coverage, etc., are easily detected. The noise level, in the absence of such defects, appears to be an indicator of…

Semiconductor materials and devicesElectronic Packaging and Soldering TechnologiesCopper Interconnects and Reliability