Published May 21, 2014 | Version v1
Journal article

Spontaneous chiral resolution in two-dimensional systems of patchy particles

  • 1. Departamento de Física, Universidad Autónoma Metropolitana-Iztapalapa, Av. San Rafael Atlixco 186, Col. Vicentina, 09340 México D.F. (Mexico)
  • 2. Instituto de Química, Universidad Nacional Autónoma de México - Apdo. Postal 70213, 04510 Coyoacán, México D.F. (Mexico)

Description

Short ranged potentials and their anisotropy produce spontaneous chiral resolution in a two dimensional model of patchy particles introduced in this paper. This model could represent an equimolar binary mixture (racemic mixture) of two kinds of chiral molecules (enantiomers) adsorbed to a bi-dimensional domain where only lateral short ranged interactions are present. Most racemic mixtures undergo chiral resolution due to their spatial anisotropy, the combined effect of long range forces and the thermodynamic conditions. The patchy particles are modeled as a hard disk and four different bonding sites located to produce chirality. Phase behavior and structural properties are analysed using Discontinuous Molecular Dynamics in the canonical ensemble. When the four patchy particles are separated by the angles (60°, 120°, 60°, 120°), spontaneous chiral resolution is produced, given by the formation of homochiral clusters, if started from the corresponding racemic mixture. Gel behavior is also obtained in all the systems for low temperatures and low densities

Additional details

Identifiers

Publishing Information

Journal Title
Journal of Chemical Physics
Journal Volume
140
Journal Issue
19
Journal Page Range
p. 194505-194505.5
ISSN
0021-9606
CODEN
JCPSA6

INIS

Country of Publication
United States
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
46010597
Subject category
S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
Descriptors DEI
ANISOTROPY; BINARY MIXTURES; CHIRALITY; ENANTIOMORPHS; GELS; INTERACTION RANGE; MAGNETIC DISKS; MOLECULAR DYNAMICS METHOD; PARTICLES
Descriptors DEC
CALCULATION METHODS; COLLOIDS; DISPERSIONS; DISTANCE; ISOMERS; MAGNETIC STORAGE DEVICES; MEMORY DEVICES; MIXTURES; PARTICLE PROPERTIES

Optional Information

Notes
(c) 2014 AIP Publishing LLC