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108-93-8

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Modeling of the phase equilibria of polyisobutylene in DiisobutylKetone (cas 108-93-8) with molecular mechanics08/19/2019

A method of calculating interaction parameters used in phase equilibrium calculations has been extended for predicting solvent activities of polymer solutions. A pair of interaction parameters are determined by calculating interaction energies between all pairs of molecules in the solution of in...detailed

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