화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.110, No.12 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (20 articles)

4133 - 4150 Laser probes of conformational isomerization in flexible molecules and complexes
Zwier TS
4151 - 4156 The spin mixing process of a radical pair in low magnetic field observed by transient absorption detected nanosecond pulsed magnetic field effect
Miura T, Maeda K, Arai T
4157 - 4168 Infrared spectra and density functional calculations for M(OH)(2,3) and HOMO molecules and M(OH)(2)(+) cations (M = Y, La)
Wang XF, Andrews L
4169 - 4179 Conformational study of monomeric 2,3-butanediols by matrix-isolation infrared spectroscopy and DFT calculations
Jesus AJL, Rosado MTS, Reva I, Fausto R, Eusebio ME, Redinha JS
4180 - 4187 Fluorobenzene-nucleobase interactions: Hydrogen bonding or pi-stacking?
Leist R, Frey JA, Leutwyler S
4188 - 4195 Hydrogen bonding of the nucleobase mimic 2-pyridone to fluorobenzenes: An ab initio investigation
Frey JA, Leist R, Leutwyler S
4196 - 4201 Salt and solvent effects on the kinetics of the oxidation of the excited state of the [Ru(bPY)(3)](2+) complex by S2O82-
Lopes-Costa T, Lopez-Cornejo P, Villa I, Perez-Tejeda P, Prado-Gotor R, Sanchez F
4202 - 4212 Experimental microkinetic approach of the photocatalytic oxidation of isopropyl alcohol on TiO2. Part 1. Surface elementary steps involving gaseous and adsorbed C3HxO species
Arsac F, Bianchi D, Chovelon JM, Ferronato C, Herrmann JM
4213 - 4222 Experimental microkinetic approach of the photocatalytic oxidation of isopropyl alcohol on TiO2. Part 2. From the surface elementary steps to the rates of oxidation of the C3HxO species
Arsac F, Bianchi D, Chovellon JM, Ferronato C, Herrmann JM
4223 - 4228 Quantum chemical modeling of reaction mechanism for 2-oxoglutarate dependent enzymes: Effect of substitution of iron by nickel and cobalt
Topol IA, Nemukhin AV, Salnikow K, Cachau RE, Abashkin YG, Kasprzak KS, Burt SK
4229 - 4237 Hydrogen bond detection
Thar J, Kirchner B
4238 - 4243 Second hyperpolarizabilities (gamma) of bisimidazole and bistriazole benzenes: Diradical character, charged state, and spin state dependences
Nakano M, Kishi R, Nakagawa N, Ohta S, Takahashi H, Furukawa SI, Kamada K, Ohta K, Champagne B, Botek E, Yamada S, Yamaguchi K
4244 - 4250 Experimental and computational studies of alkali-metal coinage-metal clusters
Lin YC, Sundholm D, Juselius J, Cui LF, Li X, Zhai HJ, Wang LS
4251 - 4255 Energy flow and fragmentation dynamics of N,N-dimethylisopropylamine
Gosselin JL, Minitti MP, Rudakov FM, Solling TI, Weber PA
4256 - 4259 Dipole-bound anions of beta-alanine: Canonical and zwitterionic conformers
Tian SX
4260 - 4265 Performance of multiplicity-based energy correctors for molecules containing second-row elements
Agapito LA, Maffei MG, Salazar PF, Seminario JM
4266 - 4275 Experimental and theoretical study of hyperconjugative interaction effects on NMR (1)J(CH) scalar couplings
Contreras RH, Esteban AL, Diez E, Della EW, Lochert IJ, dos Santos FP, Tormena CF
4276 - 4284 The semi-ideal solution theory for mixed ionic solutions at solid-liquid-vapor equilibrium
Hu YF, Fan SS, Liang DQ
4285 - 4285 Comment on "Theoretical investigation of the formation mechanism of metallofullerene Y@C-82"
Strout DL
4286 - 4286 Reply to "Comment on "Theoretical investigation of the formation mechanism of metallofullerene Y@C82199"
Gan LH, Wang CR