NaCl has a cubic unit cell. It is best thought of as a face-centered cubic array of anions with an interpenetrating fcc cation lattice (or vice-versa). The cell looks the same whether you start with anions or cations on the corners. Each ion is 6-coordinate and has a local octahedral geometry.
Shown below are two crystallographic planes in NaCl. Notice that the (111) plane is hexagonally closest packed.
Fig. 3 The (111) plane of NaCl.
Fig. 4 The (100 plane of NaCl.
Something that surprises novices is that the 111 plane does not contain the body centered atom. It is important for the beginning student to recognize that the 111 plane does not cut through 1/2, 1/2, 1/2! Take a look at the models above and below to convinvce yourself of this very important fact!
Here is a polyhedral representation of the NaCl unit cell. We could have drawn octahedra around either of the two atoms. In the case below, we have drawn them around the corner atoms and changed the color to improve the image contrast:
Interactive 3D models
Rotate the model by dragging it; use the mouse wheel or a pinch gesture to zoom. Notice that you can see alternating hcp layers that contain only Na and only Cl atoms if you manipulate it correctly. See the drawing of the 100 plane shown above if this orientation is not clear.
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The sticks show the neighbor connections recorded in the original model file; they are a guide to the lattice geometry. Download the selected MOL file.
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