Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.109, No.15 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

3267 - 3275	NMR paramagnetic relaxation of the spin 2 complex (MnTSPP)-T-III: A unique mechanism Schaefle N, Sharp R
3276 - 3284	NMR-paramagnetic relaxation due to the high-spin d(3) electron configuration: Cr(III)-TSPP Schaefle N, Sharp R
3285 - 3294	Electron-transfer oxidation properties of DNA bases and DNA oligomers Fukuzumi S, Miyao H, Ohkubo K, Suenobu T
3295 - 3306	Measuring the change in the intermolecular Raman spectrum during dipolar solvation Underwood DF, Blank DA
3307 - 3310	Symmetry analysis of the vibronic states in the upper conical potential (2(3)A') of triplet H-3(+) Viegas LP, Alijah A, Varandas AJC
3311 - 3317	Vibrational spectroscopy of Ni+(benzene)(n) complexes in the gas phase Jaeger TD, Duncan MA
3318 - 3324	Halogens in competition: Electronic structure of mixed dihalobenzenes Novak I, Kovac B
3325 - 3330	Reactions of germanium atoms and small clusters with CO: Experimental and theoretical characterization of Ge,CO (N=1-5) and Ge-2(CO)(2) in solid argon Zhou MF, Jiang L, Xu Q
3331 - 3336	Internal rotational motion of the chloromethyl group of the jet-cooled benzyl chloride molecule Matsumoto R, Suzuki T, Ichimura T
3337 - 3343	FTIR study of CO2 and H2O/CO2 nanoparticles and their temporal evolution at 80 K Taraschewski M, Cammenga HK, Tuckermann R, Bauerecker S
3344 - 3351	Oxidation of phenol in aqueous acid: Characterization and reactions of radical cations vis-a-vis the phenoxyl radical Das TN
3352 - 3359	High-temperature measurements of the reactions of OH with toluene and acetone Vasudevan V, Davidson DF, Hanson RK
3360 - 3371	Substitution and solvent effects on the photophysical properties of several series of 10-alkylated phenothiazine derivatives Garcia C, Oyola R, Pinero LE, Arce R, Silva J, Sanchez V
3372 - 3382	Activation/driving force relationships for cyclopropylcarbinyl -> homoallyl-type rearrangements of radical anions Chahma M, Li XZ, Phillips JP, Schwartz P, Brammer LE, Wang YH, Tanko JM
3383 - 3390	Substituent effects in the migration step of the Baeyer-Villiger rearrangement. A theoretical study Reyes L, Castro M, Cruz J, Rubio M
3391 - 3395	Ab initio study of the cyclooctatetraenyl radical Moreno-Armenta MG, Cooksy AL
3396 - 3404	Time-dependent reactive scattering for the system H-+D-2 <-> HD+D- and comparison with H-+H-2 <-> H-2+H- Morari C, Jaquet R
3405 - 3410	Conformational effects on optical rotation. 2-substituted butanes Wiberg KB, Wang YG, Vaccaro PH, Cheeseman JR, Luderer MR
3411 - 3417	Electronic ground states of iron porphyrin and of the first species in the catalytic reaction cycle of cytochrome P450s Groenhof AR, Swart M, Ehlers AW, Lammertsma K
3418 - 3424	Infrared, Raman, and inelastic neutron scattering spectra of dodecahedrane: an I-h molecule in T-h site symmetry Hudson BS, Allis DG, Parker SF, Ramirez-Cuesta AJ, Herman H, Prinzbach H
3425 - 3432	Simulation of liquid water using semiempirical Hamiltonians and the divide and conquer approach Monard G, Bernal-Uruchurtu MI, van der Vaart A, Merz KM, Ruiz-Lopez MF
3433 - 3437	The conversion of methane to methanol: A reaction catalyzed by I+ or I-2(+)? Davico GE
3438 - 3447	Density functional study of the reaction of carbon surface oxides: The behavior of ketones Sendt K, Haynes BS
3448 - 3453	Chiroptical properties of 2-chloropropionitrile Wiberg KB, Wang YG, Wilson SM, Vaccaro PH, Cheeseman JR
3454 - 3469	Time-resolved resonance Raman and density functional theory study of hydrogen-bonding effects on the triplet state of p-methoxyacetophenone Chan WS, Ma CS, Kwok WM, Phillips DL
3470 - 3475	Assessment of recently developed multicoefficient strategies for the treatment of pi-conjugated molecules Sancho-Garcia JC
3476 - 3484	N-state adiabatic-to-diabatic transformation angle: Theory and application Vertesi T, Bene E, Vibok A, Halasz GJ, Baer M
3485 - 3492	Support vector machine and the heuristic method to predict the solubility of hydrocarbons in electrolyte Ma WP, Zhang XY, Luan F, Zhang HX, Zhang RS, Liu MC, Hu ZD, Fang BT
3493 - 3500	Atomic and molecular properties of elements 112, 114, and 118 Nash CS
3501 - 3505	Temperature-dependent far-infrared spectra of single crystals of high explosives using terahertz time-domain spectroscopy Barber J, Hooks DE, Funk DJ, Averitt RD, Taylor AJ, Babikov D
3506 - 3516	Experimental and modeling approach to decolorization of azo dyes by ultrasound: Degradation of the hydrazone tautomer Ozen AS, Aviyente V, Tezcanli-Guyer G, Ince NH