Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.103, No.13 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

1913 - 1928	Correlated ab initio electronic structure calculations for large molecules Friesner RA, Murphy RB, Beachy MD, Ringnalda MN, Pollard WT, Dunietz BD, Cao YX
1929 - 1938	State-resolved photofragmentation of [ClNO](n) van der Waals clusters in a supersonic jet Conde C, Maul C, Quinones E
1939 - 1949	Proton-transfer tautomerism of 7-hydroxyquinolines mediated by hydrogen-bonded complexes Chou PT, Wei CY, Wang CRC, Hung FT, Chang CP
1950 - 1957	Triplet dynamics of conformationally distorted porphyrins in isotropic liquids and liquid crystals. Time-resolved electron paramagnetic resonance study Michaeli S, Soffer S, Levanon H, Senge MO, Kalisch WW
1958 - 1966	Internal conversion in 1-aminonaphthalenes. Influence of amino twist angle Ruckert I, Demeter A, Morawski O, Kuhnle W, Tauer E, Zachariasse KA
1967 - 1971	Approximate quantum mechanical cross sections and rate constants for the H+O-3 atmospheric reaction using novel elastic optimum angle adiabatic approaches Szichman H, Varandas AJC
1972 - 1975	The electronic structure of the (CN3)(2)N radical and the pyrolysis mechanism of dimethylnitrosamine: A HeI photoelectron spectroscopic study Qiao CH, Hong GY, Wang DX
1976 - 1985	Conformational stability of 3-fluoropropene in rare gas solutions from temperature-dependent FT-IR spectra and ab initio calculations van der Veken BJ, Herrebout WA, Durig DT, Zhao W, Durig JR
1986 - 1990	Electron spin polarizations of phthalocyaninatosilicon covalently linked to one TEMPO radical in the excited quartet and doublet ground states Ishii K, Hirose Y, Kobayashi N
1991 - 1996	Photophysical studies on molecular chirality: Ground and excited state enantioselective interactions between 2-naphthyl-1-ethanol and natural bicyclic compounds Lahmani F, Le Barbu K, Zehnacker-Rentien A
1997 - 2006	Reactivity and photoionization studies of bimetallic cobalt-manganese clusters Koretsky GM, Kerns KP, Nieman GC, Knickelbein MB, Riley SJ
2007 - 2012	Intracluster ion-molecule reactions of dimer cations of phenylsilanes Ishikawa H, Hashimoto J, Shimanuki Y, Mikami N
2013 - 2023	Infrared spectra of OMCO (M = Cr-Ni), OMCO- (M = Cr-Cu), and MCO2- (M = Co-Cu) in solid argon Zhou MF, Liang BY, Andrews L
2024 - 2030	Simultaneous thermal and plasma chemical activation of conversions in H-2-I-2-HI mixtures Miethke F, Wagner HE, Rutscher A, Gundermann S
2031 - 2043	Chlorine atom initiated oxidation of chlorinated ethenes: Results for 1,1-dichloroethene (H2C=CCl2), 1,2-dichloroethene (HClC=CClH), trichloroethene (HClC=CCl2), and tetrachloroethene (Cl2C=CCl2) Hasson AS, Smith IWM
2044 - 2049	Adsorption and desorption of HCl on ice Isakson MJ, Sitz GO
2050 - 2059	A novel small-ratio relative-rate technique for measuring OH formation yields from the reactions of O-3 with alkenes in the gas phase, and its application to the reactions of ethene and propene Paulson SE, Fenske JD, Sen AD, Callahan TW
2060 - 2065	Theoretical investigation of the reaction of O(P-3) with CH2Cl Wang BS, Hou H, Gu YS
2066 - 2075	Infrared spectra and density functional calculations for OMCO, OM-(eta(2)-CO), OMCO+, and OMOC+ (M = V, Ti) in solid argon Zhou MF, Andrews L
2076 - 2087	Kinetic isotope effect in the gas-phase reaction of muonium with molecular oxygen Himmer U, Dilger H, Roduner E, Pan JJ, Arseneau DJ, Fleming DG, Senba M
2088 - 2096	Prediction of absolute rate constants for the reactions of NH2 with alkanes from ab initio G2M/TST calculations Mebel AM, Lin MC
2097 - 2099	Fluorescence excitation spectrum of OClO ((A)over-tilde(2)A(2)) Lim SM, Kim TS, Lim GI, Kim SK, Choi YS
2100 - 2106	Theoretical investigation of the reaction of ClONO2 with H2O on water clusters Xu SC, Zhao XS
2107 - 2116	Magnesium dicyanide: Three isomers or seven? Petrie S
2117 - 2127	Multicenter integration scheme for electronic structure calculations of periodic and nonperiodic polyatomic systems Lin ZJ, Jaffe JE, Hess AC
2128 - 2133	Gaseous trihalogen cations. Formation, structure and reactivity of Cl-3(+) and Cl2F+ ions from a joint ab initio and FT-ICR study Cacace F, de Petris G, Pepi F, Rosi M, Troiani A
2134 - 2140	Ab initio and density functional theory study of the geometric structure, vibrational frequency, torsional potential, and isomerization of dichlorodisulfane (CISSCl) Das D, Whittenburg SL
2141 - 2151	Structures, vibrational frequencies and polarizabilities of diazaborinines, triazadiborinines, azaboroles, and oxazaboroles Doerksen RJ, Thakkar AJ
2152 - 2159	Direct ab initio dynamics studies of the hydrogen abstraction reactions of hydrogen atom with fluoromethanes Maity DK, Duncan WT, Truong TN
2160 - 2169	Ab initio study of the most stable C4H5 isomers Parker CL, Cooksy AL
2170 - 2174	An ab initio study on the equilibrium structure and XCN bending energy levels of halofulminates: ClCNO Koput J