Prediction of Mechanism and Thermochemical Properties of O3 + H2S Atmospheric Reaction
Ozone and hydrogen sulfide reaction mechanism including a complex was studied at the B3LYP/6-311++G(3df,3pd) and CCSD/6-311++G(3df,3pd)//B3LYP/6-311++G(3df,3pd) levels of computation. The interaction between sulfur atom of hydrogen sulfide and terminal oxygen atom of ozone produces a stable H2S-O3 c...
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| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Wiley
2013-01-01
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| Series: | Journal of Chemistry |
| Online Access: | http://dx.doi.org/10.1155/2013/659682 |
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