Brillouin zone#Critical points

{{Short description|Primitive cell in the reciprocal space lattice of crystals}}

File:Brillouin zone.svg and (b) hexagonal lattice.]]

In mathematics and solid state physics, the first Brillouin zone (named after Léon Brillouin) is a uniquely defined primitive cell in reciprocal space. In the same way the Bravais lattice is divided up into Wigner–Seitz cells in the real lattice, the reciprocal lattice is broken up into Brillouin zones. The boundaries of this cell are given by planes related to points on the reciprocal lattice. The importance of the Brillouin zone stems from the description of waves in a periodic medium given by Bloch's theorem, in which it is found that the solutions can be completely characterized by their behavior in a single Brillouin zone.

The first Brillouin zone is the locus of points in reciprocal space that are closer to the origin of the reciprocal lattice than they are to any other reciprocal lattice points (see the derivation of the Wigner–Seitz cell). Another definition is as the set of points in k-space that can be reached from the origin without crossing any Bragg plane. Equivalently, this is the Voronoi cell around the origin of the reciprocal lattice.

File:Phonon k 3k.gif of waves in the lattice, because it corresponds to a half-wavelength equal to the inter-atomic lattice spacing a.{{Cite web|url=http://solidstate.mines.edu/videonotes/VN_5_2.pdf|title=Topic 5-2: Nyquist Frequency and Group Velocity|website=Solid State Physics in a Nutshell|publisher=Colorado School of Mines}} See also {{Section link|Aliasing|Sampling sinusoidal functions}} for more on the equivalence of k-vectors.]]

File:Ibz.png.]]

There are also second, third, etc., Brillouin zones, corresponding to a sequence of disjoint regions (all with the same volume) at increasing distances from the origin, but these are used less frequently. As a result, the first Brillouin zone is often called simply the Brillouin zone. In general, the n-th Brillouin zone consists of the set of points that can be reached from the origin by crossing exactly n − 1 distinct Bragg planes. A related concept is that of the irreducible Brillouin zone, which is the first Brillouin zone reduced by all of the symmetries in the point group of the lattice (point group of the crystal).

The concept of a Brillouin zone was developed by Léon Brillouin (1889–1969), a French physicist.{{cite journal | last=Brillouin | first=L. | title=Les électrons libres dans les métaux et le role des réflexions de Bragg |trans-title=Free electrons in metals and the role of Bragg reflections| journal=Journal de Physique et le Radium | publisher=EDP Sciences | volume=1 | issue=11 | year=1930 | issn=0368-3842 | doi=10.1051/jphysrad:01930001011037700 | pages=377–400| url=https://hal.science/jpa-00233038/file/ajp-jphysrad_1930_1_11_377_0.pdf |language=fr}}

Within the Brillouin zone, a constant-energy surface represents the loci of all the \vec{k}-points (that is, all the electron momentum values) that have the same energy. Fermi surface is a special constant-energy surface that separates the unfilled orbitals from the filled ones at zero kelvin.

Critical points

File:Brillouin Zone (1st, FCC).svg, a truncated octahedron, showing symmetry labels for high symmetry lines and points]]

Several points of high symmetry are of special interest – these are called critical points.{{cite book |first1=Harald |last1=Ibach |first2=Hans |last2=Lüth |title=Solid-State Physics, An Introduction to Principles of Materials Science |edition=2nd |year=1996 |publisher=Springer-Verlag |isbn=978-3-540-58573-2}}

class="wikitable"

!Symbol!!Description

ΓCenter of the Brillouin zone
colspan="2"|Simple cube
MCenter of an edge
RCorner point
XCenter of a face
colspan="2"|Face-centered cubic
KMiddle of an edge joining two hexagonal faces
LCenter of a hexagonal face
UMiddle of an edge joining a hexagonal and a square face
WCorner point
XCenter of a square face
colspan="2"|Body-centered cubic
HCorner point joining four edges
NCenter of a face
PCorner point joining three edges
colspan="2"|Hexagonal
ACenter of a hexagonal face
HCorner point
KMiddle of an edge joining two rectangular faces
LMiddle of an edge joining a hexagonal and a rectangular face
MCenter of a rectangular face

Other lattices have different types of high-symmetry points. They can be found in the illustrations below.

class="wikitable"

|+ Brillouin zone types{{cite journal | first1=Wahyu | last1=Setyawan | first2=Stefano | last2=Curtarolo | title=High-throughput electronic band structure calculations: Challenges and tools | journal=Computational Materials Science | volume=49 | issue=2 | pages=299–312 | year=2010 | doi =10.1016/j.commatsci.2010.05.010 | arxiv=1004.2974 |bibcode=2010arXiv1004.2974S| s2cid=119226326 }}

! Lattice system

! Bravais lattice

(Abbreviation)

Triclinic

! Primitive triclinic

(TRI)

| Triclinic Lattice type 1a (TRI1a)

225px

| Triclinic Lattice type 1b (TRI1b)

225px

| Triclinic Lattice type 2a (TRI2a)

225px

| Triclinic Lattice type 2b (TRI2b)

200px

rowspan="2" |Monoclinic

! Primitive monoclinic

(MCL)

| Monoclinic Lattice (MCL)

225px

Base-centered monoclinic

(MCLC)

| Base-centered monoclinic lattice type 1 (MCLC1)

225px

| Base-centered monoclinic lattice type 2 (MCLC2)

225px

| Base-centered monoclinic lattice type 3 (MCLC3)

225px

| Base-centered monoclinic lattice type 4 (MCLC4)

225px

| Base-centered monoclinic lattice type 5 (MCLC5)

225px

rowspan="4" | Orthorhombic

! Primitive orthorhombic

(ORC)

| Simple orthorhombic lattice (ORC)

225px

Base-centered orthorhombic

(ORCC)

|Base-centered orthorhombic lattice (ORCC)

225px

Body-centered orthorhombic

(ORCI)

| Body-centered orthorhombic lattice (ORCI)

225px

Face-centered orthorhombic

(ORCF)

| Face-centered orthorhombic lattice type 1 (ORCF1)

225px

| Face-centered orthorhombic lattice type 2 (ORCF2)

225px

| Face-centered orthorhombic lattice type 3 (ORCF3)

225px

rowspan="2" | Tetragonal

! Primitive tetragonal

(TET)

| Simple tetragonal lattice (TET)

225px

Body-centered Tetragonal

(BCT)

| Body-centered tetragonal lattice type 1 (BCT1)

225px

| Body-centered tetragonal lattice type 2 (BCT2)

225px

Rhombohedral

! Primitive rhombohederal

(RHL)

| Rhombohedral lattice type 1 (RHL1)

225px

| Rhombohedral lattice type 2 (RHL2)

225px

Hexagonal

! Primitive hexagonal

(HEX)

| Hexagonal lattice (HEX)

225px

rowspan="3" | Cubic

! Primitive cubic

(CUB)

| Simple cubic lattice (CUB)

225px

Body-centered cubic

(BCC)

| Body-centered cubic lattice (BCC)

225px

Face-centered cubic

(FCC)

| Face-centered cubic lattice (FCC)

225px

==See also==

File:Brillouin-zone construction by 300keV electrons.jpg, using 300 keV electrons.]]

References

Bibliography

  • {{cite book |first=Charles |last=Kittel |author-link=Charles Kittel |title=Introduction to Solid State Physics |publisher=Wiley |location=New York |year=1996 |isbn=978-0-471-14286-7 |title-link=Solid State Physics}}
  • {{cite book |first1=Neil W. |last1=Ashcroft |author-link=Neil William Ashcroft | first2=N. David | last2=Mermin | author2-link=David Mermin | title=Solid State Physics |publisher=Harcourt |location=Orlando |year=1976 |isbn=978-0-03-049346-1|title-link=Solid State Physics }}
  • {{cite journal |first=Léon |last=Brillouin |author-link=Léon Brillouin |url=http://gallica.bnf.fr/ark:/12148/bpt6k31445 |title=Les électrons dans les métaux et le classement des ondes de de Broglie correspondantes |journal=Comptes Rendus Hebdomadaires des Séances de l'Académie des Sciences |volume=191 |issue=292 |year=1930}}