2021
DOI: 10.1002/zaac.202100206
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A Combined Theoretical and Photoelectron Spectroscopy Study of Al3Hn (n=1–9) clusters

Abstract: Combined photoelectron spectroscopic experiments and computational studies have been performed on Al 3 H n À (n = 1-9) clusters. Three modes of hydrogen bonding to the Al 3 moiety have been observed: terminal, bridging, and capping. Among various hydrides, Al 3 H 5 À and Al 3 H 8 À clusters have highest HOMO-LUMO gap and largest electron affinity, respectively. Our studies indicate that as the number of hydrogen atoms increase the presence of AlH 2 groups, representing the tetrahedral coordination of the Al at… Show more

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