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Computational Quantum Mechanics for Materials Engineers: The EMTO Method and Applications

โœ Scribed by Levente Vitos


Publisher
Springer
Year
2007
Tongue
English
Leaves
238
Series
Engineering Materials and Processes
Edition
1st Edition.
Category
Library

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โœฆ Synopsis


Traditionally, new materials have been developed by empirically correlating their chemical composition, and the manufacturing processes used to form them, with their properties. Until recently, metallurgists have not used quantum theory for practical purposes. However, the development of modern density functional methods means that today, computational quantum mechanics can help engineers to identify and develop novel materials.


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