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Perovskite (pronunciation: / p ə ˈ r ɒ v s k aɪ t /) is a calcium titanium oxide mineral composed of calcium titanate (chemical formula Ca Ti O 3).Its name is also applied to the class of compounds which have the same type of crystal structure as CaTiO 3, known as the perovskite structure, which has a general chemical formula A 2+ B 4+ (X 2−) 3. [6]
Perovskite structures are adopted by many compounds that have the chemical formula ABX 3. 'A' and 'B' are positively charged ions (i.e. cations), often of very different sizes, and X is a negatively charged ion (an anion, frequently oxide) that bonds to both cations. The 'A' atoms are generally larger than the 'B' atoms.
The perovskite structure is frequently found for ternary oxides formed with one large (A) and one small cation (B). In this structure, there is a simple cubic array of B cations, with the A cations occupying the center of the cube, and the oxide atoms are sited at the center of the 12 edges of the simple cube. [8] [5] [6] [7]
The typical perovskite structure is represented by the general formula ABX 3, where A and B are cations and X is an anion. When the anion is the ( divalent ) oxide ion, A and B cations can have charges 1 and 5, respectively, 2 and 4, respectively, or 3 and 3, respectively.
Ruddlesden-Popper (RP) phases are a type of perovskite structure that consists of two-dimensional perovskite-like slabs interleaved with cations.The general formula of an RP phase is A n+1 B n X 3n+1, where A and B are cations, X is an anion (e.g., oxygen), and n is the number of octahedral layers in the perovskite-like stack. [1]
The following oxidation–reduction tree for a simple ionic compound, AX, where A is a cation and X is an anion, summarizes the various ways in which intrinsic defects can form. Depending on the cation-to-anion ratio, the species can either be reduced and therefore classified as n-type, or if the converse is true, the ionic species is ...
In addition to these cations, gold was also shown to be a suitable candidate for cation exchange yielding a mixed-valent, and distorted, perovskite with the composition Cs 2 Au(I)Au(III)Br 6. [102] A-site cation exchange has also been shown to be a viable route for the transformation of CsPbBr 3 to MAPbBr 3 and from CsPbI 3 to FAPbI 3. [82]
For typical ionic solids, the cations are smaller than the anions, and each cation is surrounded by coordinated anions which form a polyhedron.The sum of the ionic radii determines the cation-anion distance, while the cation-anion radius ratio + / (or /) determines the coordination number (C.N.) of the cation, as well as the shape of the coordinated polyhedron of anions.