Magnesium phase diagrams: Have you seen us?
ORAL
Abstract
Because of it's high strength-to-weight ratio, magnesium is seen as promising material for automotive applications. But magnesium alloys are far less understood that more common alloys such as steel or newer alloys such as aluminum. Even among simple binary magnesium systems, there is a great deal of missing information. There are binary magnesium systems for which no phase diagrams appear in the latest databases (the Pauling File, for example). Using a high-throughput approach, we have undertaken a broad search for ground states in 40 magnesium binary systems using more than 8000 fully-relaxed first-principles calculations. We find new, non-obvious ordering systems and many systems where there are unsuspected ground states. We discuss the results and their potential impact on magnesium alloys.
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Authors
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Gus Hart
Brigham Young University
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Stefano Curtarolo
Duke University, Duke University, Department of Mechanical Engineering and Materials Science and Department of Physics, Department of Mechanical Engineering and Materials Science and Department of Physics, Duke University - Durham NC 27708