Published on Physical Review A (http://pra.aps.org)


October 1995

Crystallographic Notation

Lattice Position
$\frac{1}{2}$$\frac{1}{4}$0 Position in a unit cell: coordinates measured along axes in units of corresponding cell dimensions. Each coordinate is thus 0 or a proper fraction, except that in NaCl-type crystals the unit-cell dimension is often taken as 2.
Symbols based on Miller Indices
(These are integers, not all 0, with no common factor; −h is represented by $\overline{h}$)
[hkl] Direction; set of parallel axes; an axis in such a set. This is not the name of a vector; one may write k||[110] but not k=[110]. In noncubic crystals the direction [hkl] is not in general orthogonal to the plane (hkl), and it is sometimes convenient to specify directions in terms of the perpendicular planes. In that case, “(100) direction” and “{100} directions” are legitimate. Be sure to warn the reader explicitly if you use this notation, and write “direction” each time.
⟨hkl⟩ Set of directions or axes equivalent to [hkl] under the symmetry group of the crystal; a direction or axis in the set. For example, in a cubic crystal the⟨100⟩ directions are [100], [010], [001], [100], [010], and [001].
 (hkl) Plane; set of parallel planes. N.B. Use commas for a vector, but not for a plane: (kx , ky , kz) represents the vector k in terms of Cartesian coordinates and is a point with that radius vector.
 {hkl} Set of planes equivalent to (hkl) under the symmetry group; a plane in that set.

Hexagonal Notation

In a hexagonal lattice, the forms [hkk'l], etc., are often used, the redundant index k'= −h−k corresponding to the third equivalent axis. [hk.l] and [hk l] are also used. Similarly, points can be labeled h, k, k , l or hk.l, for example, $\frac{1}{3},\frac{1}{3},-\frac{2}{3}$, 0 or $\frac{1}{3}\frac{1}{3}$.0. The latter form is not widely known or used in the United States, and so the preferred style of Physical Review is to use the forms h, k, k', l, [hkk', l], and (hkk'l) for points, directions, and planes, respectively.

Examples of Usage

H is in the [001] direction or in a ⟨001⟩ direction
The six {100} faces of a cube
The two opposite (100) faces of a cube

APS  |  Journals  |  Privacy  |  Policies  |  Contact Information  |  PRA  |  Join APS  |  Feedback

ISSN 1094-1622 (online), 1050-2947 (print). Use of the American Physical Society websites and journals implies that the user has read and agrees to our Terms and Conditions and any applicable Subscription Agreement. Physical Review A ® is a trademark of the American Physical Society.


Source URL: http://pra.aps.org/authors/crystallographic-notation-h1