Ab initio Calculation Tutorial: For Materials Analysis, Informatics and Design - Ryo Maezono
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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 combine ... Full description
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Description
More Information
| Author | Ryo Maezono |
|---|---|
| Publisher | Springer Nature Singapore |
| Release year | 2024 |
| Cover type | Softcover |
| EAN | 9789819909216 |