نتایج جستجو برای: tetragonal structure

تعداد نتایج: 1570279  

تجبر, ناصر, فوجی, ابولقاسم,

A software in fortran is developed to determine crystal structure of cubic. tetragonal. hexago nal and orthorhombic crystals from powder ditTraction d values. The general 1t6s method is also used for triclinic and monoclinic crystals.

2016
Xiaofang Lai Ying Liu Xujie Lü Sijia Zhang Kejun Bu Changqing Jin Hui Zhang Jianhua Lin Fuqiang Huang

Pressure is a powerful tool to study iron-based superconductors. Here, we report systematic high-pressure transport and structural characterizations of the newly discovered superconductor FeS. It is found that superconductor FeS (tetragonal) partly transforms to a hexagonal structure at 0.4 GPa, and then completely transforms to an orthorhombic phase at 7.4 GPa and finally to a monoclinic phase...

2011
K. Schuller

In situ neutron powder diffraction measurements show that the orthorhombic-to-tetragonal phase transition in YBa2Cu307 —,which occurs near 700 C in a pure oxygen atmosphere, is an order-disorder transition in which the disordering of oxygen atoms into a normally vacant site destroys the one-dimensional Cu-0 chains present in the room-temperature orthorhombic structure. For both structures, the ...

M. Ghatee, M.H. Shariat,

Abstract: Zirconia solid electrolytes with nonequilibrium composite structure were prepared by impregnation of a porous 8YSZ matrix with a solution of Zirconia. Microstructures were characterized by XRD and SEM. The electrical properties were studied by impedance spectroscopy as a function of temperature. Biaxial flexural strength and fracture toughness of composite samples were measured by rin...

2013
Anil Kumar Karin M. Rabe Umesh V. Waghmare

We determine the relative thermodynamic stability of competing homogeneously and inhomogeneously ordered ferroelectric phases of PbTiO3 using its free-energy landscape, obtained from constrained-polarization moleculardynamics simulations with a first-principles effective Hamiltonian and thermodynamic integration. While we find that the tetragonal structure is thermodynamically most stable at te...

Journal: :Physical chemistry chemical physics : PCCP 2013
Alexander Kuhn Jürgen Köhler Bettina V Lotsch

Tetragonal Li10GeP2S12 (LGPS) is the best solid Li ion conductor known to date. So far, the structure of the electrolyte was only determined from powder diffraction and Rietveld refinement. Here, we present the first single-crystal structure analysis of the tetragonal LGPS structure. The reported structure is largely verified. However, an additional Li position is clearly identified which might...

   Physical study of nano ribbon, tetragonal bundled and isolated nano tube SiC (7,0) are part of our project in knowing new nano material such a silicon carbide. These studies have been performed by density function theory. Effect of ribboning, tubulating and tetragonal bundling on the physical properties such as stability, structural constants, optical physics, chemical parameters and mag...

2006
Alan D. Mighell

A lattice metric singularity occurs when unit cells defining two (or more) lattices yield the identical set of unique calculated d-spacings. The minerals Mawsonite and Chatkalite are of especial interest as both are characterized by tetragonal unit cells that correspond to the second member of a quaternary lattice metric singularity. This singularity includes lattices that are Cubic I, Tetragon...

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