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## Ab initio calculations Competition and cooperativity between hydrogen bond and r-hole bond in SCS-(HF) n (n = 1 and 2) systems, 90 Activation energies The reaction mechanism of ozone with the NO and NO 2 oxides, 74 Adsorption Adsorption of di-, tri-and polyatomic gases on the anatase TiO 2 (0 0 1) and ( 10 1) surfaces and their adsorption abilities, 103 AIM Effect of CH 3 CO functional group on the molecular and electronic properties of BN43zz nanotube: A computational chemistry study, 36 Novel halogen bonding interactions between MH 2 (M = Mg, Be) and HX (X = Cl, Br, I) molecules, 84 Properties of halogen bonds in FArCCXAEAEAEHMY (X = Cl and Br; M = Be and Mg; Y = H, F, and CH 3 ) complexes: An ab initio and topological analysis, 115 Theoretical prediction characters of unconventional weak bond with carbene as electron donors and Li-Y (Y = OH, H, F, NC and CN) as electron acceptors, 56 Alkyl acetates Quantum chemical calculations of the homogeneous, unimolecular, gas-phase elimination kinetics of primary alkyl acetates and (dimethylamino)alkyl acetates: Neighboring group participation in 4-(dimethylamino)-1-butyl acetate, 46 Amino acid ionic liquid DFT study on the structure an

Who reads Subject Index?

Publisher

Elsevier Science; Elsevier ; Elsevier BV (ISSN 0166-1280)

Published

2010

Language

EN

Field

Chemistry (Physical Sciences)