TY - JOUR
T1 - Low-radii transitions in co-assembled cationic-anionic cylindrical aggregates
AU - Del Rosario Lim, Marc Michael
AU - Velichko, Yuri S.
AU - De La Cruz, Monica Olvera
AU - Vernizzi, Graziano
PY - 2008/5/1
Y1 - 2008/5/1
N2 - We investigate the formation of charged patterns on the surface of cylindrical micelles from co-assembled cationic and anionic amphiphiles. The competition between the net incompatibility χ (which arises from the different chemical nature of oppositely charged molecules) and electrostatic interactions (which prevent macroscopic segregation) results in the formation of surface domains. We employ Monte Carlo simulations to study the domains at thermal equilibrium. Our results extend previous work by studying the effect of the Bjerrum length lB at different values of the cylinder's radius R and χ and analyze how it affects the transition between helical, ring, and isotropic patterns. A critical surface in the space (lB, R, χ) separating these three phases is found, and we show how it corresponds to a first-order phase transition. This confirms that the Bjerrum length l B is a significant parameter in the control of the helical-ring transition; the ring pattern is strongly associated with short-range forces, whereas the helical pattern develops from dominant long-range electrostatic interactions.
AB - We investigate the formation of charged patterns on the surface of cylindrical micelles from co-assembled cationic and anionic amphiphiles. The competition between the net incompatibility χ (which arises from the different chemical nature of oppositely charged molecules) and electrostatic interactions (which prevent macroscopic segregation) results in the formation of surface domains. We employ Monte Carlo simulations to study the domains at thermal equilibrium. Our results extend previous work by studying the effect of the Bjerrum length lB at different values of the cylinder's radius R and χ and analyze how it affects the transition between helical, ring, and isotropic patterns. A critical surface in the space (lB, R, χ) separating these three phases is found, and we show how it corresponds to a first-order phase transition. This confirms that the Bjerrum length l B is a significant parameter in the control of the helical-ring transition; the ring pattern is strongly associated with short-range forces, whereas the helical pattern develops from dominant long-range electrostatic interactions.
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U2 - 10.1021/jp7105132
DO - 10.1021/jp7105132
M3 - Article
C2 - 18393545
AN - SCOPUS:47149086568
SN - 1520-6106
VL - 112
SP - 5423
EP - 5427
JO - Journal of Physical Chemistry B
JF - Journal of Physical Chemistry B
IS - 17
ER -