화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.110, No.35 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (19 articles)

10371 - 10374 Photophysical properties of near-infrared-emitting Ln(III) complexes with 1-(9-anthryl)-4,4,4-trifluoro-1,3-butandione (Ln = Nd and Er)
Nah MK, Cho HG, Kwon HJ, Kim YJ, Park C, Kim HK, Kang JG
10375 - 10383 Quasi-classical trajectory calculations analyzing the reactivity and dynamics of asymmetric stretch mode excitations of methane in the H+CH4 reaction
Rangel C, Corchado JC, Espinosa-Garcia J
10384 - 10391 Dynamics in supercooled ionic organic liquids and mode coupling theory analysis
Li J, Wang I, Fruchey K, Fayer MD
10392 - 10403 Gas-phase acidities and O-H bond dissociation enthalpies of phenol, 3-methylphenol, 2,4,6-trimethylphenol, and ethanoic acid
Angel LA, Ervin KM
10404 - 10408 Electronic absorption spectra of the protonated polyacetylenes H2CnH+ (n=4, 6, 8) in neon matrixes
Batalov A, Fulara J, Shnitko I, Maier JP
10409 - 10418 Contrasting products in the reactions of Cr, Mo, and W atoms with H2O2: Argon matrix infrared spectra and theoretical calculations
Wang XF, Andrews L
10419 - 10426 Reactions of group 3 transition metal atoms with CS2 and OCS: Matrix isolation infrared spectra and density-functional calculations of SMCS, SM-(eta(2)-CS), SMCO, and SM-(eta(2)-CO) in solid argon
Baker AB, Andrews L
10427 - 10434 Thermal lens spectroscopy in cryogenic solutions: Analysis and comparison of intensities in CH4-N-2 and CH4-Ar liquid solutions
Lopez-Calvo A, Manzanares CE
10435 - 10443 On the reactive uptake of gaseous compounds by organic-coated aqueous aerosols: Theoretical analysis and application to the heterogeneous hydrolysis of N2O5
Anttila T, Kiendler-Scharr A, Tillmann R, Mentel TF
10444 - 10455 Measurement of effective Knudsen diffusion coefficients for powder beds used in heterogeneous uptake experiments
Boulter JE, Marschall J
10456 - 10464 Br-2 production from the heterogeneous reaction of gas-phase OH with aqueous salt solutions: Impacts of acidity, halide concentration, and organic surfactants
Frinak EK, Abbatt JPD
10465 - 10477 Pointers toward the occurrence of C-F center dot center dot center dot F-C interaction: Experimental charge density analysis of 1-(4-fluorophenyl)-3,6,6-trimethyl-2-phenyl-1,5,6,7-tetrahydro-4H-indol-4-one and 1-(4-fluorophenyl)-6-methoxy-2-phenyl-1,2,3,4-tetrahydroisoquinoline
Chopra D, Cameron TS, Ferrara JD, Row TNG
10478 - 10486 Assessment of density functionals for pi systems: Energy differences between cumulenes and poly-ynes; Proton affinities, bond length alternation, and torsional potentials of conjugated polyenes; and proton affinities of conjugated Shiff bases
Zhao Y, Truhlar DG
10487 - 10494 Structure, vibrational spectrum, and ring puckering barrier of cyclobutane
Blake TA, Xantheas SS
10495 - 10500 Computational studies on stable triplet states of heteroacetylenes and the effects of halogen substituents
Cheng MJ, Cheng HM, Chu SY
10501 - 10506 Interaction energy of a water molecule with a single-layer graphitic surface modeled by hydrogen- and fluorine-terminated clusters
Sudiarta IW, Geldart DJW
10507 - 10512 Characteristics of multiple N,O bonds
Love I
10513 - 10520 Minimum-error method for scattering problems in quantum mechanics: Two stable and efficient implementations
Temel B, Mills G, Metiu H
10521 - 10524 Computational study of pharmacophores: beta-lactams
Novak I, Chua PJ