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Mechanism of O3 and NO2 detection and selectivity of In2O3 sensors

✍ Scribed by M Ivanovskaya; A Gurlo; P Bogdanov


Book ID
108469369
Publisher
Elsevier Science
Year
2001
Tongue
English
Weight
94 KB
Volume
77
Category
Article
ISSN
0925-4005

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## Abstract The atmospheric reaction NO~2~ + O~3~ β†’ NO~3~ + O~2~ (1) has been investigated theoretically by using the MP2, G2, G2Q, QCISD, QCISD(T), CCSD(T), CASSCF, and CASPT2 methods with various basis sets. The results show that the reaction pathway can be divided in two different parts at the M