Effect of water on the oxidation of CO by a Criegee intermediate
The present work employs the CCSD(T)/CBS//M06-2X/aug-cc-pVTZ level of theory to investigate the effect of a water monomer and dimer on the oxidation of carbon-monoxide by a Criegee intermediate (CH2OO).
1925 ◽
Vol 47
(1)
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pp. 123-142
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Keyword(s):
2003 ◽
Vol 68
(3)
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pp. 191-205
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Keyword(s):