Stable structures of nitrogen-rich sulfides: N3SN4 and S(N4)m (m=1-4)

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DOIResolve DOI: http://doi.org/10.1016/S0009-2614(02)02035-3
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TypeArticle
Journal titleChemical Physics Letters
Volume369
Issue3-4
Pages386393; # of pages: 8
AbstractStable structures of nitrogen-rich sulfides SN4, N3SN4, and S(N4)m2- (m=1-4) were studied. Two of SN4, three of SN42+, two of SN42-, one of SN4- and two transition structures of the dissociation reactions of SN4 were obtained. Four stable species of N3SN4, and a transition structure of the dissociation reaction of N3SN4 were calculated. In the set of S(N4)m2- (m=2-4), the sulfur atom with large atomic radius and loose electron density allows it connect more nitrogen clusters N4 to form nitrogen-rich sulfides S(N4)m2-. SNx may be used as high energy-density material combining with opposite ion.
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AffiliationNational Research Council Canada; NRC Steacie Institute for Molecular Sciences
Peer reviewedNo
NPARC number12328796
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Record identifiere37dbad4-c7c6-4ecb-aa15-fd657f61c81d
Record created2009-09-10
Record modified2016-05-09
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