Algorithm development in computational chemistry

<p>This thesis presents algorithm development in computational chemistry, and applies new computer science concepts to voltammetric simulation. To begin, this thesis discusses why algorithm development is necessary, and inherent problems found in commercial simulation solvers. As a result of...

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Bibliographic Details
Main Author: Cutress, I
Other Authors: Compton, R
Format: Thesis
Language:English
Published: 2011
Subjects: