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Optimizing atomic structures through geno-mathematical programming
<p>In this paper, we describe our initiative to utilize a modern well-tested numerical</p><p>
</p><p>platform in the field of material physics: the Genetic Hybrid Algorithm (GHA).</p><p>
</p><p>Our aim is to develop a ...
The surface energy and stress of metals
We investigated surface properties of metals by performing first-principles calculations. A systematic database was established for the surface relaxation, surface energy (gamma), and surface stress (tau) for metallic ...