Electronic band structures of metal hydrides

作者: A.C. Switendick

DOI: 10.1016/0038-1098(70)90720-9

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摘要: Abstract First principles energy band calculations of rare earth hydrides RHx for PrH2, PrH3, ErH2, ErH3 and YH0, TH2 YH3 are discussed in terms the prototypes YH2 PrH3. The location states added by hydrogen atom is determined leads to a new model understanding metal hydrides. A non-rigid invoked elucidate phase changes semiconducting behavior x non-integral.

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