LEADER 02699oam 2200433 450 001 9910424637203321 005 20230823001310.0 010 $a981-15-6986-X 024 7 $a10.1007/978-981-15-6986-9 035 $a(CKB)4100000011528362 035 $a(MiAaPQ)EBC6381967 035 $a(DE-He213)978-981-15-6986-9 035 $a(EXLCZ)994100000011528362 100 $a20210415d2020 uy 0 101 0 $aeng 135 $aurnn|008mamaa 181 $ctxt$2rdacontent 182 $cc$2rdamedia 183 $acr$2rdacarrier 200 00$aDirect hydroxylation of methane $einterplay between theory and experiment /$fKazunari Yoshizawa, editor 205 $a1st ed. 2020. 210 1$aGateway East, Singapore :$cSpringer,$d[2020] 210 4$d©2020 215 $a1 online resource (V, 165 p. 107 illus., 55 illus. in color.) 311 $a981-15-6985-1 320 $aIncludes bibliographical references. 327 $a1. Physical properties of methane -- 2. Methane hydroxylation by transition-metal oxide ions -- 3. Enzymatic methane hydroxylation by methane monooxyganese -- 4. Methane and benzene oxidation by metal-exchanged zeolites -- 5. Methane activation on metal-oxide surfaces -- 6. Methane activation on alloy surface: Informatics approach -- 7. Synergy of theory and experiment. 330 $aThis book focuses on theoretical and computational studies by the editor?s group on the direct hydroxylation of methane, which is one of the most challenging subjects in catalyst chemistry. These studies of more than 20 years include gas-phase reactions by transition-metal oxide ions, enzymatic reactions by two types of methane monooxygenase (soluble and particulate MMO), catalytic reactions by metal-exchanged zeolites, and methane C?H activation by metal oxide surfaces. Catalyst chemistry has been mostly empirical and based on enormous experimental efforts. The subject of the title has been tackled using the orbital interaction and computations based on extended Hückel, DFT, and band structure calculations. The strength of the theoretical studies is in the synergy between theory and experiment. Therefore, the group has close contacts with experimentalists in physical chemistry, catalyst chemistry, bioinorganic chemistry, inorganic chemistry, and surface chemistry. This resulting book will be useful for the theoretical analysis and design of catalysts. . 606 $aMethane 615 0$aMethane. 676 $a622.5 702 $aYoshizawa$b Kazunari 801 0$bMiAaPQ 801 1$bMiAaPQ 801 2$bUtOrBLW 906 $aBOOK 912 $a9910424637203321 996 $aDirect hydroxylation of methane$92087463 997 $aUNINA