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Stylish this thesis methods in computational chemical science are used to improve the perceptive of the chemical science of CO2absorption stylish amine-water systems. The work is besides intended to bring home the bacon models that stern be used to predict the execution of new solvents. Such predictive models are intended to facilitate the cover for new solvents.Author: da Silva, Eirik FalckCited by: Put out Year: 2005
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It uses methods of academic chemistry, incorporated into computer programs, to calculate the structures and properties of molecules, groups of molecules, and solids.
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Computational chemical science allows using different models analyze and predict the behaviour of single and composite materials to determine the composing of new materials.
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