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Computational chemistry is a means of applying theoretical ideas using computers and a set of techniques for investigating chemical problems within which common
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Computational chemistry has become extremely important in the last decade, being widely used in academic and industrial research. Yet there have been few books
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This corrected second edition contains new material which includes solvent effects, the treatment of singlet diradicals, and the fundamentals of computaional ch
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Computational Chemistry and Molecular Modeling
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The gap between introductory level textbooks and highly specialized monographs is filled by this modern textbook. It provides in one comprehensive volume the in