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QUANTUM CHEMICAL CALCULATION OF(Li_(4)·Li_(2)H_(2))_(x) CHAIN BY ab initio METHOD

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摘要 There is still no serious study about the electronic structure of the molten salt-metal interface. In a previous work, one of the authors of this paper here studied the electronic structure of molten salt-liquid metal mixtures, and proved that these solutions contained various atomic cluster ions. It seems meaningful to calculate some models simulating molten salt-metal interface by quantum chemical calculation.
出处 《Chinese Science Bulletin》 SCIE EI 1987年第9期603-604,共2页
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