Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.109, No.32 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (38 articles)

6993 - 6997	The C2H3+O-2 reaction revisited: Is multireference treatment of the wave function really critical? Mebel AM, Kislov VV
6998 - 7000	Innershell absorption spectroscopy of amino acids at all relevant absorption edges Zubavichus Y, Shaporenko A, Grunze M, Zharnikov M
7001 - 7012	Computational studies of DNA photolyase Harrison CB, O'Neil LL, Wiest O
7013 - 7023	Kramers-Kronig transformation for optical rotatory dispersion studies Polavarapu PL
7024 - 7032	Compartmental modeling of reversible intermolecular two-state excited-state processes coupled with rotational diffusion or with added quencher Boens N, Novikov E, Ameloot M
7033 - 7045	Probing excited-state dynamics and intramolecular proton transfer in 1-acylaminoanthraquinones via the intermolecular solvent response Schmidtke SJ, Underwood DF, Blank DA
7046 - 7056	Cluster size selectivity in the product distribution of ethene dehydrogenation on niobium clusters Parnis JM, Escobar-Cabrera E, Thompson MGK, Jacula JP, Lafleur RD, Guevara-Garcia A, Martinez A, Rayner DM
7057 - 7067	Infrared photodissociation spectroscopy of Mg+(H2O)Ar-n complexes: Isomers in progressive microsolvation Walker NR, Walters RS, Tsai MK, Jordan KD, Duncan MA
7068 - 7072	C-13 NMR pattern of SC3N@C-68. Structural assignment of the first fullerene with adjacent pentagons Reveles JU, Heine T, Koster AM
7073 - 7087	Solid-state Nb-93 and C-13 NMR investigations of half-sandwich niobium(I) and niobium(V) cyclopentadienyl complexes Lo AYH, Bitterwolf TE, Macdonald CLB, Schurko RW
7088 - 7093	The electronic and vibrational structure of endohedral Tm3N@C-80 (I) fullerene - Proof of an encaged Tm3+ Krause M, Liu XJ, Wong J, Pichler T, Knupfer M, Dunsch L
7094 - 7098	Metal ion binding by a bicyclic diamide: Deep UV Raman spectroscopic characterization Shashilov VA, Ermolenkov VV, Levitskaia TG, Lednev IK
7099 - 7112	Mid-infrared extinction spectra and optical constants of supercooled water droplets Wagner R, Benz S, Mohler O, Saathoff H, Schnaiter M, Schurath U
7113 - 7120	CH stretching vibrational overtone spectra of 1,3,5,7-cyclooctatetraene and 1,1,1-trichloroethane Petryk MWP, Henry BR
7121 - 7126	Photophysics of aromatic molecules with low-lying pi sigma* states: Excitation-energy dependence of fluorescence in jet-cooled aromatic nitriles Ramos RC, Fujiwara T, Zgierski MZ, Lim EC
7127 - 7133	Doppler-free two-photon excitation spectroscopy and the Zeeman effects. Perturbations in the 14(0)(1) and 1(0)(1)14(0)(1) bands of the S-1 <-S-0 transition of C6D6 Baek DY, Wang JG, Doi A, Kasahara S, Kato H, Baba M
7134 - 7139	Spectroscopic and quantum chemical study of cyclopropylmethylphosphine, a candidate for intramolecular hydrogen bonding Cole GC, Mollendal H, Guillemin JC
7140 - 7150	Product study of the photolysis of ketene and ethyl ethynyl ether at 193.3 nm Fockenberg C
7151 - 7165	Influence of monolayer amounts of HNO3 on the evaporation rate of H2O over ice in the range 179 to 208 K: A quartz crystal microbalance study Delval C, Rossi MJ
7166 - 7171	Optical constants of HNO3/H2O and H2SO4/HNO3/H2O at low temperatures in the infrared region Myhre CEL, Grothe H, Gola AA, Nielsen CJ
7172 - 7180	Photodissociation mechanism of nitramide: A CAS-SCF and MS-CASPT2 study Arenas JF, Otero JC, Pelaez D, Soto J
7181 - 7186	Mechanisms of electron-ion recombination of N2H+/N2D+ and HCO+/DCO+ ions: Temperature dependence and isotopic effect Poterya V, McLain JL, Adams NG, Babcock LM
7187 - 7196	Density functional theory and the correlation consistent basis sets: The tight d effect on HSO and HOS Wang NX, Wilson AK
7197 - 7206	Tuning of electronic structures of poly(p-phenylenevinylene) analogues of phenyl, thienyl, furyl, and pyrrolyl by double-bond linkages of group 14 and 15 elements Wang YJ, Ma J, Jiang YS
7207 - 7215	Electronic states of SnS and SnS+: A configuration interaction study Giri D, Das KK
7216 - 7224	Reaction paths of the water-assisted neutral hydrolysis of ethyl acetate Yamabe S, Tsuchida N, Hayashida Y
7225 - 7235	Theoretical study on the photochemical behavior of 4-(dimethylamino)benzonitrile Amatatsu Y
7236 - 7241	Impacts of quantization on the properties of liquid water de la Pena LH, Razul MSG, Kusalik PG
7242 - 7250	Theoretical studies of alkyl radicals in the NaY and HY zeolites Ghandi K, Zahariev FE, Wang YA
7251 - 7257	Magnetic anisotropy of [Mo(CN)(7)](4-) anions and fragments of cyano-bridged magnetic networks Chibotaru LF, Hendrickx MFA, Clima S, Larionova J, Ceulemans A
7258 - 7263	Understanding solid-state reactions of organic crystals with density functional theory-based concepts Feng SX, Li TL
7264 - 7275	Intramolecular nitro-assisted proton transfer in photoirradiated 2-(2',4'-dinitrobenzyl)pyridine: Polarized optical spectroscopic study and electronic structure calculations Naumov P, Sakurai K, Ishikawa T, Takahashi J, Koshihara SY, Ohashi Y
7276 - 7284	Role of donor-acceptor strengths and separation on the two-photon absorption response of cytotoxic dyes: A TD-DFT study Badaeva EA, Timofeeva TV, Masunov AM, Tretiak S
7285 - 7295	Triazolium-based energetic ionic liquids Schmidt MW, Gordon MS, Boatz JA
7296 - 7308	G3(MP2) study of the C3H6O+center dot isomers fragmented from 1,4-dioxane(+center dot) Lam CS, Li WK, Chiu SW
7309 - 7318	Nonconventional hydrogen bonding between clusters of gold and hydrogen fluoride Kryachko ES, Karpfen A, Remacle F
7319 - 7328	Global investigation on the potential energy surface of CH3CN: Application of the scaled hypersphere search method Yang X, Maeda S, Ohno K
7329 - 7338	Charge-transfer complexation as a general phenomenon in the copigmentation of anthocyanins da Silva PF, Lima JC, Freitas AA, Shimizu K, Macanita AL, Quina FH