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Ab initio Calculation Tutorial

- For Materials Analysis, Informatics and Design
Engelsk Hardback

Ab initio Calculation Tutorial

- For Materials Analysis, Informatics and Design
Engelsk Hardback

720 kr
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Om denne bog

This textbook covers the framework of first-principles analysis applied to materials using density functional theory (DFT). It provides a set of hands-on tutorials using the Quantum ESPRESSO package, an open-source software for DFT. The tutorials are well chosen, designed for maximum effectiveness while requiring a minimum of the reader''s time, and the book describes how the essential components are combined to create the practical applications based on the idea of modeling practical problems of materials. The book carefully explains how to prepare the platform to run the tutorials assisted by free software. This textbook is useful for students in experimental laboratories, for industrial researchers, and for those not majoring in theoretical studies but learning individually.



Product detaljer
Sprog:
Engelsk
Sider:
277
ISBN-13:
9789819909186
Indbinding:
Hardback
Udgave:
ISBN-10:
981990918X
Udg. Dato:
17 maj 2023
Længde:
25mm
Bredde:
243mm
Højde:
161mm
Forlag:
Springer Verlag, Singapore
Oplagsdato:
17 maj 2023
Forfatter(e):
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