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Symmetry for Quasicrystals

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Presentation on theme: "Symmetry for Quasicrystals"— Presentation transcript:

1 Symmetry for Quasicrystals
References: F. Samavat et. al., Open Journal of Physical Chemistry, 2012, 2, 7-14.

2 Definition of Quasicrystals (QCs)
Materials With perfect long-range order, but with no 3D translational periodicity. Sharp diffraction spots non-crystallographic rotational symmetry Old definition of Crystals Definition till 1991: A crystal is a solid where the atoms form a periodic arrangement.

3 New Definition for Crystal
International Union of Crystallography, “Report of the Executive Committee for 1991”, Acta Cryst., A48, (1992), 922. “ … By crystal, we mean any solid having an essentially discrete diffraction diagram, and by aperiodic crystal we mean any crystal in which three dimensional lattice periodicity can be considered to be absent” Diffraction Pattern  crystals !

4 Periodicity Order Crystals Quasicrystals Amorphous Crystals
Quasicrystals X Amorphous X X Crystals Quasicrystals Translation, t inflation,  Rotation 1, 2, 3, 4, 6 Rotation 1, 2, 3, 4, 5, 6, 8, 10, 12 τ : scaling ratio

5 Quasiperiodic in 3D (no periodic direction)
Types of QCs Quasiperiodic in 2D (polygonal or dihedral QCs, one periodic direction  the quasiperodic layers) Octagonal QCs: local 8-fold symmetry [P & I] Decagonal QCs: local 10-fold symmetry [P] Dodecagonal QCs: local 12-fold symmetry [P] Quasiperiodic in 3D (no periodic direction) Icosahedral QCs: (axes:12x5-fold, 20x3-fold, 30x2-fold) [P, I & F] new type (reported in Nature, Nov.2000) “Icosahedral" QCs with broken symmetry (stable binary Cd5.7Yb)

6 Chris J. Pickard and R. J. Needs, Nature Materials 9,624–627
Octagonal QCs Chris J. Pickard and R. J. Needs, Nature Materials 9,624–627

7 Decagonal QCs

8 Dodecagonal QCs

9 Icosahedral QCs http://en.wikipedia.org/wiki/File:Icosahedron.gif
Schematic drawings of the unit cell of fcc Zr2Ni structure (a) and examples of icosahedral clusters around Zr and Ni atoms in the unit cell (b). J. Saida et al., Intermetallics, V. 10, Issues 11–12, November 2002, Pages 1089–1098 Icosahedral QCs

10 Simulations of some diffraction patterns
F. Samavat et. al., Open Journal of Physical Chemistry, 2012, 2, 7-14. A simulation from an icosahedral quasicrystal

11  4  3  2

12 Example of 1D QCs

13  Cut and Project Fibonacci sequence (1D QCs)
Harald Bohr, Acta Mathematicae, 45, 580 (1925) Make a cut in a 2D space and project the mathematical points onto a 1D space, a line, and get a 1D quasicrystal Ignore anything outside of the two lines E.g. : Fibonacci number Choose   tan irrational number (why?) Make cuts in a 6D space and project in 3D space  3D QCs

14 Aperiodic Periodic Aperiodic crystal Periodic crystal ~ approximant (called)

15 Fibonacci number (series, sequence)
Fibonacci Rabbits: Fibonacci’s Problem: If a pair of new born rabbits are put in a pen, how many pairs of rabbits will be in the pen? Assumptions: 1. Can produce once every month 2. Always produce one male and one female offspring 3. Can reproduce once they are one month old 4. The rabbits never die

16 1st month continue Birth 2nd month Grow up 3rd month 4th month 5th month 6th month Month 1 2 1 3 2 4 3 5 6 8 7 8 21 # of pairs 13 ?

17 Fibonacci number 0, 1, 1, 2, 3, 5, 8, 13, 21, 34, 55, 89, 144, 233, 377, 610, ….. The sequence Fn of Fibonacci numbers is defined by the recurrence relation Golden ratio

18 B A B B A B A B BA B BA BA B BA B BA BAB BA BAB BAB BA BAB BA BAB
1-D QC

19 Chattopadhyay et al., 1985a and Bendersky, 1985
Type of quasicrystal QP+ Metric Symmetry System First Report Icosahedral 3 D (5) AlMn Shechtman et al. 1984 Cubic 3D 3 VNiSi Feng et al 1989 Tetrahedral AlLiCu Donnadieu 1994 Decagonal 2D 10/mmm Chattopadhyay et al., 1985a and Bendersky, 1985 Dodecagonal 12/mmm NiCr Ishimasa et al. 1985

20 Type of quasicrystal QP+ Metric Symmetry System
First Report Octagonal 2D 2 8/mmm VNiSi, CrNiSi Wang et al. 1987 Pentagonal (5) AlCuFe Bancel 1993 Hexagonal 3 6/mmm AlCr Selke et al. 1994 Trigonal 1D AlCuNi Chattopadhyay et al., Digonal 222 AlCuCo He et al. 1988

21 Ho-Mg-Zn Quasicrystal
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