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Density functional theory's self-interaction correction falters in transition metals, study finds"One flaw is the self-interaction error, which occurs when an electron interacts with itself ... Recent research in DFT and SIC has focused on transition metals, which are crucial for catalysts ...
The observation of a Mott transition from a metal to an insulator in an ultraclean carbon nanotube could open the door to a new generation of experiments that explore the influence of electron ...
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