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Computational chemistry :

Lewars, Errol.

Computational chemistry : introduction to the theory and applications of molecular and quantum mechanics / Errol Lewars. - Boston : Kluwer Academic, c2003. - x, 471 p. : ill. (some col.) ; 24 cm.

Includes bibliographical references and index.

8181284763


Chemistry, Physical and theoretical--Computer simulation.
Chemistry--Data processing.
Quantum chemistry--Computer simulation.
Molecular structure--Computer simulation.

541.0113 / LEC