Cooperative polymerization of one-patch colloids
Creators
- 1. Sapienza, Università di Roma, Piazzale Aldo Moro 2, 00185, Roma (Italy)
Description
We numerically investigate cooperative polymerization in an off-lattice model based on a pairwise additive potential using particles with a single attractive patch that covers 30% of the colloid surface. Upon cooling, these particles self-assemble into small clusters which, below a density-dependent temperature, spontaneously reorganize into long straight tubes. We evaluate the partition functions of clusters of all sizes to provide an accurate description of the chemical reaction constants governing this process. Our calculations show that, for intermediate sizes, the partition functions retain contributions from two different structures, differing in both energy and entropy. We illustrate the microscopic mechanism behind the complex polymerization process in this system and provide a detailed evaluation of its thermodynamics
Additional details
Identifiers
- DOI
- 10.1063/1.4869834;
Publishing Information
- Journal Title
- Journal of Chemical Physics
- Journal Volume
- 140
- Journal Issue
- 14
- Journal Page Range
- p. 144902-144902.10
- ISSN
- 0021-9606
- CODEN
- JCPSA6
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 45074469
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
- Descriptors DEI
- COLLOIDS; DENSITY; ENTROPY; EVALUATION; PARTITION FUNCTIONS; POLYMERIZATION; SURFACES; THERMODYNAMICS
- Descriptors DEC
- CHEMICAL REACTIONS; DISPERSIONS; FUNCTIONS; PHYSICAL PROPERTIES; THERMODYNAMIC PROPERTIES
Optional Information
- Notes
- (c) 2014 AIP Publishing LLC