AB Initio Calculation Tutorial: For Materials Analysis, Informatics and Design

By Ryo Maezono

Book Overview

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,... This description may be from another edition of this product.

• Format: Hardcover
• Language: English
• ISBN: 9819239966
• ISBN13: 9789819239962
• Release Date: November 2026
• Publisher: Springer
• Length: 331 Pages