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Parallel algorithm for numerical self-consistent field theory simulations of block copolymer structure
Authors:Scott W Sides  Glenn H Fredrickson
Affiliation:Chemical Engineering II, Chemical Engineering, University of California at Santa Barbara (UCSB), Santa Barbara, CA 93106, USA
Abstract:An efficient algorithm is presented for numerically evaluating a self-consistent field theoretic (SCFT) model of block copolymer structure. This algorithm is implemented on a distributed memory parallel cluster in order to solve the SCFT equations on large computational grids. Simulation results are presented for a two-component molten mixture of a symmetric ABA triblock copolymer with an A homopolymer. These results illustrate a case in which simulating a large system is required to resolve features with a wide range of length scales.
Keywords:61  25  Hq  61  43  Bn  64  75  +g  64  60  Cn  64  70  Nd
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