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Li3–O–Li3 molecule: A metal-nonmetal-metal sandwichlike compound with a distending electron cloud
作者:Wei Chen, Zhi-Ru Li, Di Wu, Ying Li, and Chia-Chung Sun
关键字:metal-nonmetal-metal sandwichlike
论文来源:期刊
发表时间:2005年

The D3d and D2d isomers of the Li3–O–Li3 molecule are metal-nonmetal-metal sandwichlike
structures that contain two Li3 superalkali atoms. Their geometries and the real frequencies are
obtained at the CCSDT/aug-cc-pVDZ level.