화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.110, No.41 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (22 articles)

11599 - 11601 Much improved upper limit for the rate constant for the reaction of O-2(+) with N-2
Viggiano AA
11602 - 11604 The kinetics of thermal decomposition of 1-butyl-3-methylimidazolium hexafluorophosphate
Zaitsau DH, Paulechka YU, Kabo GJ
11605 - 11612 Respective contributions of polar vs enthalpy effects in the addition/fragmentation of mercaptobenzoxazole-derived thiyl radicals and analogues to double bonds
Lalevee J, Allonas X, Morlet-Savary F, Fouassier JP
11613 - 11616 Activation of electron-transfer reduction of oxygen by hydrogen bond formation of superoxide anion with ammonium ion
Ohkubo K, Kitaguchi H, Fukuzumi S
11617 - 11626 Vibrational spectra and structures of H2O-NO, HDO-NO, and D2O-NO complexes. An IR matrix isolation and DFT study
Dozova N, Krim L, Alikhani ME, Lacome N
11627 - 11635 Generation of gas-phase VO2+, VOOH+, and VO2+-nitrile complex ions by electrospray ionization and collision-induced dissociation
Parsons Z, Leavitt C, Duong T, Groenewold GS, Gresham GL, Van Stipdonk MJ
11636 - 11644 Direct dynamics study on the reaction of N2H4 with F atom: A hydrogen abstraction reaction?
Zhang X, Li QS
11645 - 11653 Absorption cross sections of formaldehyde at wavelengths from 300 to 340 nm at 294 and 245 K
Smith CA, Pope FD, Cronin B, Parkes CB, Orr-Ewing AJ
11654 - 11664 Diffusion kinetics for methanol in polycrystalline ice
Marchand P, Riou S, Ayotte P
11665 - 11676 Estimation of electronic coupling for intermolecular electron transfer from cross-reaction data
Nelsen SF, Weaver MN, Pladziewicz JR, Ausman LK, Jentzsch TL, O'Konek JJ
11677 - 11683 Decomposition and isomerization of 1,2-benzisoxazole: Single-pulse shock-tube experiments, quantum chemical and transition-state theory calculations
Lifshitz A, Tamburu C, Suslensky A, Dubnikova F
11684 - 11694 Proton transfers induced by lead(II) in a uracil nucleobase: A study based on quantum chemistry calculations
Gutle C, Salpin JY, Cartailler T, Tortajada J, Gaigeot MP
11695 - 11703 Molecular motion in crystalline naphthalene: Analysis of multi-temperature X-ray and neutron diffraction data
Capelli SC, Albinati A, Mason SA, Willis BTM
11704 - 11710 Solvent effects on the photodissociation of formic acid: A theoretical study
Tian YC, Fang WH
11711 - 11716 Structure and stability of networked metallofullerenes of the transition metals
Sparta M, Borve KJ, Jensen VR
11717 - 11729 Structure, bonding, and lowest energy transitions in unsymmetrical squaraines: A computational study
Yesudas K, Chaitanya GK, Prabhakar C, Bhanuprakash K, Rao VJ
11730 - 11733 Preferential site of attack on fullerene cations: Frontier orbitals and rate coefficients
Lee KH, Lee C, Kang J, Park SS, Lee J, Lee SK, Bohme DK
11734 - 11751 A new perspective in the Lewis acid catalyzed ring opening of epoxides. Theoretical study of some complexes of methanol, acetic acid, dimethyl ether, diethyl ether, and ethylene oxide with boron trifluoride
Saenz P, Cachau RE, Seoane G, Kieninger M, Ventura ON
11752 - 11759 On the electronic origin of strain energy: QTAIM study of perfluorocycloalkanes
Vila A, Mosquera RA
11760 - 11764 Theoretical study of hydrogen bonding interaction in nitroxyl (HNO) dimer: Interrelationship of the two N-H center dot center dot center dot O blue-shifting hydrogen bonds
Liu Y, Liu WQ, Li HY, Liu JG, Yang Y
11765 - 11769 The singlet-triplet gap in trimethylenmethane and the ring-opening of methylenecyclopropane: A multireference Brillouin-Wigner coupled cluster study
Brabec J, Pittner J
11770 - 11779 Experimental and molecular dynamics studies of dysprosium(III) salt solutions for a better representation of the microscopic features used within the binding mean spherical approximation theory
Ruas A, Guilbaud P, Den Auwer C, Moulin C, Simonin JP, Turq P, Moisy P