(2,0,0) plane for simple cubic lattice

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Discussion Overview

The discussion centers around the existence and significance of the (2,0,0) Miller index plane in a simple cubic lattice, exploring its implications in the context of X-ray diffraction and atomic arrangements within the lattice structure.

Discussion Character

  • Exploratory
  • Technical explanation
  • Debate/contested

Main Points Raised

  • Fei questions the existence of the (2,0,0) plane in a simple cubic lattice, noting that it intersects the x-axis at 1/2*a and is parallel to the y and z axes, but observes that there are no atoms in this plane.
  • UBY responds by stating that a simple cubic lattice can have a multiple-atom basis, using cesium chloride as an example, suggesting that the (2,0,0) plane can contribute to diffraction due to the presence of atoms in the unit cell.
  • Fei inquires about the physical meaning of the (2,0,0) plane specifically for Polonium, which has a simple cubic structure with a single atom basis.
  • A later reply clarifies that while a (200) reflection exists for a single-atom basis, its intensity is related to the (100) reflection, indicating that only a fraction of the (200) planes are present in the crystal.

Areas of Agreement / Disagreement

Participants express differing views on the significance of the (2,0,0) plane, with some suggesting it has relevance in certain contexts while others highlight the absence of atoms in that plane for specific structures, indicating that the discussion remains unresolved.

Contextual Notes

The discussion involves assumptions about the atomic basis of the lattice and the implications for diffraction patterns, which may vary depending on the specific material being considered.

feiyangflash
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Hi All,

Does the plane of miller index (2,0,0) exist in simple cubic lattice?

It is easy to understand that (1,0,0) plane exist. But for (2,0,0) plane, I feel confused.

If (2,0,0) plane exists, the plane intersect with the x-axis at 1/2*a, if a is the lattice constant; and the plane is parallel with y-axis and z-axis. However, there is no atoms deployed in this plane! Is there any physical meaning for this plane, since no atom is there? When the X-ray diffraction is done, does this plane ever play a role?

Thank you!

Fei
 
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Hi Fei,

A simple cubic lattice can have a multiple-atom basis. For example, cesium chloride is simple cubic with a two atom basis. The atom at the center of the cell would create a diffraction at the (200) plane. In fact, for simple cubic, all reflections are possible due to the very high degree of symmetry.
 
Hi UBY,

Thank you! Your explanation makes sense.

The alpha form of Polonium (Po) has a simple cubic crystal structure in a single atom basis. Does the plane (2,0,0) have a physical meaning for Polonium?


uby said:
Hi Fei,

A simple cubic lattice can have a multiple-atom basis. For example, cesium chloride is simple cubic with a two atom basis. The atom at the center of the cell would create a diffraction at the (200) plane. In fact, for simple cubic, all reflections are possible due to the very high degree of symmetry.
 
For a single-atom basis, a (200) reflection will still exist, but only as a family member of the (100) reflection. In other words, its intensity would be related to the intensity of the (100) reflection by a geometric factor indicating the fraction of planes present (1/2).

In 2D, draw a series of parallel lines and pretend they are the (100) planes. Now draw a series of dashed lines in between these. The dashed lines AND the parallel lines represent all the equivalent (200) reflections, but only half are actually present in the crystal (the dashed lines are unoccupied).
 

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