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Computer Simulations

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  • A new theory for Semiconductors made of nanocrystals

    Researchers at ETH have provided the first theoretical explanation for how electrical current is conducted in semiconductors made of nanocrystals. In the future, this could lead to the development of new sensors, lasers or LEDs for TV screens. A few years ago, we were introduced to TV screens featur more

  • Predicting unpredictable reactions

    Computational catalysis, a field that simulates and accelerates the discovery of catalysts for chemicals production, has largely been limited to simulations of idealized catalyst structures that do not necessarily represent structures under realistic reaction conditions. New research from the Univer more

  • Characterizing and designing lubricants on the computer

    Lubricated shafts, bearings and gears only run 'like clockwork' when the components slide on a perfect lubricating film, generating as little friction, wear and energy loss as possible. To achieve this, engineers need to know the behavior of the lubricant film in the so-called tribo-contact, which i more

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