화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.102, No.51 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (17 articles)

10443 - 10454 Mixed quantum/classical dynamics of hydrogen transfer reactions
Hammes-Schiffer S
10455 - 10459 Comparison between experimental and three-dimensional quantum mechanical rate constants for the NH(D)+NO reactions
Szichman H, Baer M, Volpp HR, Wolfrum J
10460 - 10468 Raman and infrared spectra, conformational stability, normal coordinate analysis, vibrational assignment, and AB initio calculations of difluoromethylcyclopropane
Durig JR, Yu ZH, Guirgis GA, Little TS, Zhen MZ, Lee MJ
10469 - 10475 Reduction of monophosphaallenes: An EPR study and ab initio investigations of (HPCCH2)(-center dot) and (HPCHCH2)(center dot) radicals
Chentit M, Sidorenkova H, Geoffroy M, Ellinger Y
10476 - 10485 Hydrogen bonding and intermolecular vibrations of 6-hydroxyquinoline H2O in the S-0 and S-1 states
Bach A, Hewel J, Leutwyler S
10486 - 10492 Ionization potentials for the titanium, zirconium, and the mixed metal Met-Cars
Sakurai H, Castleman AW
10493 - 10500 The mechanism of the gas-phase ion-molecule reaction between Al+ and ethanol
Stockigt D
10501 - 10511 Kinetics and mechanism of the IO+BrO reaction
Bedjanian Y, Le Bras G, Poulet G
10512 - 10521 Oxidation of (carboxyalkyl)thiopropionic acid derivatives by hydroxyl radicals. Mechanisms and kinetics of competitive inter- and intramolecular formation of sigma- and sigma*-type sulfuranyl radicals
Bobrowski K, Pogocki D, Schoneich C
10522 - 10529 Mechanistic and kinetic study of the gas-phase reaction of hydroxyl radical with dimethyl sulfoxide
Urbanski SP, Stickel RE, Wine PH
10530 - 10535 Substituent effects on the structure and aromaticity of 4-silatriafulvene
Veszpremi T, Takahashi M, Hajgato B, Ogasawara J, Sakamoto K, Kira M
10536 - 10539 Theoretical investigation of the ground X-3 Sigma(-) state of nitrogen bromide
Kalemos A, Mavridis A, Xantheas SS
10540 - 10544 Complexes of sulfuric acid with hydrogen chloride, water, nitric acid, chlorine nitrate, and hydrogen peroxide: An ab initio investigation
Beichert P, Schrems O
10545 - 10551 Density functional modeling of long range magnetic interactions in binuclear oxomolybdenum(V) complexes
Bencini A, Gatteschi D, Totti F, Sanz DN, Mc Cleverty JA, Ward MD
10552 - 10559 Origin of autocatalysis in the biphasic alkaline hydrolysis of C-4 to C-8 ethyl alkanoates
Buhse T, Lavabre D, Nagarajan R, Micheau JC
10560 - 10567 Elemental chlorine and chlorine fluoride: Theoretical and experimental proton affinity and the gas phase chemistry of Cl2H+ and FClH+ ions
Cacace F, de Petris G, Pepi F, Rosi M, Sgamellotti A
10568 - 10571 Isotopic GCMS study of the mechanism of methane partial oxidation to synthesis gas
Hu YH, Ruckenstein E