Marco Fronzi
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Hands-on introduction to the capabilities of machine learning models for efficient and accurate prediction of material properties. | |
Marco Fronzi
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This tutorial is intended to provide a practical implementation of Density Functional Theory (DFT) that illustrates the basic principles of DFT. It focuses on the calculations of fundamental quantities essential to DFT. | |
Marco Fronzi
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Collection of scripts to estimate code runtime, speedup, and efficiency on high-performance computing platforms. |