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Computation CHANGE TOPIC

Computation and theory

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Read our latest series and find out about materials science researchers in New Zealand and Australia.

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Using analytical techniques, scientists have discovered how the atomic structure of lithium-rich battery cathodes evolves during charging and discharging.

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Scientists have determined the mechanisms that cause tiny wires of molybdenum disulfide to extend into tungsten diselenide at their interface.

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A novel model derived from more than 400 computer simulations of natural composite materials can help scientists develop synthetic versions.

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Scientists have discovered the fastest magnesium-ion solid-state conductor, which could find use as a solid electrolyte in magnesium-ion batteries.

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Scientists have disentangled the intriguing dynamics of how electron stripes melt and form on quantum materials.

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By studying an unprecedented range of disordered solids, scientists have defined a parameter called 'softness’ that can predict the location of defects.

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Submit your nomination for the inaugural Rising Stars in Computational Materials Science SI & prize.

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