2016
DOI: 10.1039/c6sm01180b
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Self-assembly of a space-tessellating structure in the binary system of hard tetrahedra and octahedra

Abstract: We report the formation of a binary crystal of hard polyhedra due solely to entropic forces. Although the alternating arrangement of octahedra and tetrahedra is a known space-tessellation, it had not previously been observed in self-assembly simulations. Both known one-component phases - the dodecagonal quasicrystal of tetrahedra and the densest-packing of octahedra in the Minkowski lattice - are found to coexist with the binary phase. Apart from an alternative, monoclinic packing of octahedra, no additional c… Show more

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Cited by 20 publications
(17 citation statements)
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“…ref. [1][2][3][4][5][6]. Several sub-problems have to be distinguished, among them is the question of the maximum density and other characteristics of a randomly packed arrangement, the so-called random close packing, or the quest for the maximum achievable packing density in regular structures.…”
Section: Introductionmentioning
confidence: 99%
“…ref. [1][2][3][4][5][6]. Several sub-problems have to be distinguished, among them is the question of the maximum density and other characteristics of a randomly packed arrangement, the so-called random close packing, or the quest for the maximum achievable packing density in regular structures.…”
Section: Introductionmentioning
confidence: 99%
“…Environments of particles i and j are only compared if M i = M j , and thus, a one-to-one mapping is possible; otherwise, particles i and j are automatically deemed nonmatching. The threshold t = 0.2 r cut was chosen for all systems because 0.2 or 0.3 times the approximate nearest-neighbor distance ( r cut ) has proven appropriate—neither too stringent nor too lenient—in other contexts ( 67 , 68 ). Figure S2 explores the impact of threshold choice on crystallinity characterization as we explain next.…”
Section: Methodsmentioning
confidence: 99%
“…Here, the entropy of the individual configurations comes into play. In simulations, one can force the system by repeated growth and shrinking of the ensemble [43], or by adding Brownian motion [44][45][46][47]. In many respects, these systems can be considered as analogues of colloidal crystals.…”
Section: Introductionmentioning
confidence: 99%