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Structure of HIF

Authors: Rodney J. Bartlett; Luis Kahn; George D. Purvis;

Structure of HIF

Abstract

The triatomic, inorganic free radical of unknown structure, HIF, is characterized by ab initio correlated many-body theory. The calculations show that HIF has a bond angle of 137.5±3°, bond lengths R(HI) = 1.64±0.5 Å and R(IF) = 2.04±0.5 Å, and a ground state of 2A′ symmetry. The computed dissociation energy for the process HIF→IF+H is 25 kcal/mole, while the experimental value is 30. The bonding in HIF is very similar to a noncollinear superposition of the two diatomic molecules HI and IF. Correlated calculations for IF, HI, HF, and the electron affinity of F are also reported. The accuracy of the dissociation energy in HIF directly parallels the accuracy of the F electron affinity.

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
24
Average
Top 10%
Average
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