Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5387351 | Chemical Physics Letters | 2008 | 5 Pages |
Abstract
Neutral Ga2S3 and Ga3S2 have similar C2ν 'V' gas phase equilibrium geometry. Ga2S3-adopts the C2ν kite geometry while Ga3S2-prefers the three dimensional geometry having D3h symmetry. The predicted adiabatic electron affinities of Ga2S3- and Ga3S2- are 3.30 eV and 2.76 eV at the CCSD(T)//B3LYP/6-311+G(2df) level.
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Authors
Neelum Seeburrun, Edet F. Archibong, Ponnadurai Ramasami,