Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.105, No.5 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (19 articles)

791 - 795	Theoretical analysis of complementary molecular memory devices Seminario JM, Zacarias AG, Derosa PA
796 - 809	Vibrational energy transfer modeling of nonequilibrium polyatomic reaction systems Barker JR, Yoder LM, King KD
810 - 814	Anomalous fluorescence of terrylene in neon matrix Deperasinska I, Kozankiewicz B, Biktchantaev I, Sepiol J
815 - 822	Rate constants for the gas-phase reactions of ozone with isoprene, alpha- and beta-pinene, and limonene as a function of temperature Khamaganov VG, Hites RA
823 - 828	Excited state isomerization kinetics of 4-(methanol)stilbene: Application of the isodielectric Kramers-Hubbard analysis Wiemers KL, Kauffman JF
829 - 837	A new pH oscillator: The chlorite-sulfite-sulfuric acid system in a CSTR Frerichs GA, Mlnarik TM, Grun RJ, Thompson RC
838 - 848	How the fourteen most stable CH4P2 isomers interconvert - An ab initio/NMR study Dransfeld A, Landuyt L, Flock M, Nguyen MT, Vanquickenborne LG
849 - 868	Theoretical study of indium compounds of interest for organometallic chemical vapor deposition Cardelino BH, Moore CE, Cardelino CA, Frazier DO, Bachmann KJ
869 - 874	Ab initio study of possible and preferred basic site(s) in polyfunctional N-1,N-1-dimethyl-N-2-cyanoformamidine Makowski M, Raczynska ED, Chmurzynski L
875 - 879	Direct characterization of radical species generated on one-electron oxidation of 3,6-diamino-10-methylacridan Marcinek A, Zielonka J, Adamus J, Gebicki J, Platz MS
880 - 884	Toward a density-based representation of reactivity: S(N)2 reaction Knoerr EH, Eberhart ME
885 - 894	Absorption spectra of several metal complexes revisited by the time-dependent density-functional theory-response theory formalism Boulet P, Chermette H, Daul C, Gilardoni F, Rogemond F, Weber J, Zuber G
895 - 904	Benchmark ab initio energy profiles for the gas-phase S(N)2 reactions Y-+CH3X -> CH3Y+X- (X,Y = F,Cl,Br). Validation of hybrid DFT methods Parthiban S, de Oliveira G, Martin JML
905 - 912	An ab initio and Raman investigation of sulfate ion hydration Pye CC, Rudolph WW
913 - 922	Density functional calculations of methyllithium, t-butyllithium, and phenyllithium oligomers: Effect of hyperconjugation on conformation Kwon O, Sevin F, McKee ML
923 - 929	The trans-bent structures of the acetylene and methylacetylene radical anions Huang MB, Liu YJ
930 - 934	What parameters determine N-N and O-O coupling constants ((2h)Jx-x) across X-H+-X hydrogen bonds? Del Bene JE, Perera SA, Bartlett RJ
935 - 941	Calculation of the structures, stabilities, and properties of mercury sulfide species in aqueous solution Tossell JA
942 - 950	Ground-state proton transfer tautomer of Al(III)-salicylate complexes in ethanol solution Wang Z, Friedrich DM, Ainsworth CC, Hemmer SL, Joly AG, Beversluis MR