Literature DB >> 21290063

Structures of manganese polysulfides: mass-selected photodissociation and density functional calculations.

Yu-Chao Zhao1, Jinyun Yuan, Zeng-Guang Zhang, Hong-Guang Xu, Weijun Zheng.   

Abstract

Manganese polysulfide cations, MnS(x)(+) (x = 1-10), were studied with mass-selected photodissociation experiments and density functional calculations. We found that MnS(+), MnS(2)(+) and MnS(3)(+) undergo dissociation at 355 nm by loss of S, S(2) and S(3), respectively. The dissociation of larger clusters is relatively complex because of the existence of multiple isomers and multiple dissociation channels. The geometric structures of the low-lying isomers found by theoretical calculations are consistent with the dissociation channels observed in the experiments. The dissociation of MnS(x)(+) clusters occurs mainly by breaking of the Mn-S bonds since they are weaker than the S-S bonds.

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Year:  2011        PMID: 21290063     DOI: 10.1039/c0dt01179g

Source DB:  PubMed          Journal:  Dalton Trans        ISSN: 1477-9226            Impact factor:   4.390


  2 in total

1.  Probing the structural and electronic properties of aluminum-sulfur AlnSm (2≤n+m≤6) clusters and their oxides.

Authors:  Ming-Min Zhong; Xiao-Yu Kuang; Zhen-Hua Wang; Peng Shao; Li-Ping Ding
Journal:  J Mol Model       Date:  2012-08-08       Impact factor: 1.810

2.  Probing the geometries, relative stabilities, and electronic properties of neutral and anionic Ag(n)S(m) (n + m ≤ 7) clusters.

Authors:  Li-Li Han; Xiao-Yu Kuang; Li-Ping Ding; Peng Shao; Yuan-Yuan Jin; Hong-Hong Li
Journal:  J Mol Model       Date:  2014-05-10       Impact factor: 1.810

  2 in total

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