Tag Archives: CMS

A Computational Look into Melting Predicts a Very High Melting Compound

This paper from Axel van de Walle’s group sounds interesting: Researchers predict material with record-setting melting point [see also this WaPo story]: The experimental record-holder is a substance made from the elements hafnium, tantalum, and carbon (Hf-Ta-C). But these new … Continue reading

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A computational look into melting

Here’s a neat computational study published in last week’s Science: Microscopic mechanisms of equilibrium melting of a solid by Amit Samanta, Mark E. Tuckerman, Tang-Qing Yu, Weinan E [though you might first want to read the commentary — Melting mechanisms: … Continue reading

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