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Unit cell definition using parallelepiped with lengths a, b, c and angles between the sides given by α, β, γ [1]. A lattice constant or lattice parameter is one of the physical dimensions and angles that determine the geometry of the unit cells in a crystal lattice, and is proportional to the distance between atoms in the crystal.
The geometry of the unit cell is defined as a parallelepiped, providing six lattice parameters taken as the lengths of the cell edges (a, b, c) and the angles between them (α, β, γ). The positions of particles inside the unit cell are described by the fractional coordinates ( x i , y i , z i ) along the cell edges, measured from a reference ...
The Born–Landé equation is a means of calculating the lattice energy of a crystalline ionic compound.In 1918 [1] Max Born and Alfred Landé proposed that the lattice energy could be derived from the electrostatic potential of the ionic lattice and a repulsive potential energy term.
[63] [64] Lennard-Jones potential can typically describe the lattice parameters, surface energies, and approximate mechanical properties. [65] Many-body potentials often contain tens or even hundreds of adjustable parameters with limited interpretability and no compatibility with common interatomic potentials for bonded molecules.
In mathematical physics, a lattice model is a mathematical model of a physical system that is defined on a lattice, as opposed to a continuum, such as the continuum of space or spacetime. Lattice models originally occurred in the context of condensed matter physics , where the atoms of a crystal automatically form a lattice.
The Born–Mayer equation is an equation that is used to calculate the lattice energy of a crystalline ionic compound.It is a refinement of the Born–Landé equation by using an improved repulsion term.
In crystallography, a lattice plane of a given Bravais lattice is any plane containing at least three noncollinear Bravais lattice points. Equivalently, a lattice plane is a plane whose intersections with the lattice (or any crystalline structure of that lattice) are periodic (i.e. are described by 2d Bravais lattices). [1]
This is based on the fact that a reciprocal lattice vector (the vector indicating a reciprocal lattice point from the reciprocal lattice origin) is the wavevector of a plane wave in the Fourier series of a spatial function (e.g., electronic density function) which periodicity follows the original Bravais lattice, so wavefronts of the plane wave ...