Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.103, No.17 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (25 articles)

3139 - 3143	Optimized parameters for scaling correlation energy Fast PL, Corchado J, Sanchez ML, Truhlar DG
3144 - 3154	Experimental and theoretical studies on the intramolecular charge-transfer emission of phenyldisilanes Yamamoto M, Kudo T, Ishikawa M, Tobita S, Shizuka H
3155 - 3162	Zero-field splitting of the electronic ground and lowest excited triplet states of 2,2-dinaphthylcarbene in n-hexane at 1.7 K Kozankiewicz B, Aloshyna M, Gudmundsdottir AD, Platz MS, Orrit M, Tamarat P
3163 - 3170	Spectroscopic study of a symmetrical bis-crown fluoroionophore of the diphenylpentadienone series Marcotte N, Fery-Forgues S, Lavabre D, Marguet S, Pivovarenko VG
3171 - 3183	Characterization of the reaction products of laser-ablated early lanthanide metal atoms with molecular oxygen. Infrared spectra of LnO, LnO(+), LnO(-), LnO(2), LnO(2)(+), LnO(2)(-), and LnO(3)(-), and (LnO)(2) in solid argon Willson SP, Andrews L
3184 - 3192	Structure and picosecond excited-states dynamics in isolated, supercooled 4-(N,N-dimethylamino)benzonitrile Salgado FP, Herbich J, Kunst AGM, Rettschnick RPH
3193 - 3199	Observation of the A(2)Sigma(+)<- X-2 Pi electronic transition of NaO Joo S, Worsnop DR, Kolb CE, Kim SK, Herschbach DR
3200 - 3209	Master equation and molecular dynamics simulations of spatiotemporal effects in a bistable chemical system Gorecki J, Kawczynski AL, Nowakowski B
3210 - 3215	Absolute reaction rate of chlorine atoms with chloroiodomethane Kambanis KG, Argyris DY, Lazarou YG, Papagiannakopoulos P
3216 - 3221	Kinetics of the CH2CH2Cl reversible arrow-C2H4+Cl reaction Knyazev VD, Kalinovski IJ, Slagle IR
3222 - 3227	Effect of pressure on local order in liquid dimethyl sulfoxide Czeslik C, Jonas J
3228 - 3236	Laser flash photolysis studies of radical-radical reaction kinetics: The HO2+IO reaction Cronkhite JM, Stickel RE, Nicovich JM, Wine PH
3237 - 3244	Rate coefficients for the reactions of OH and OD with HCl and DCl between 200 and 400 K Battin-Leclerc F, Kim IK, Talukdar RK, Portmann RW, Ravishankara AR
3245 - 3251	SIMOMM: An integrated molecular orbital/molecular mechanics optimization scheme for surfaces Shoemaker JR, Burggraf LW, Gordon MS
3252 - 3267	Ab initio studies of silica-based clusters. Part I. Energies and conformations of simple clusters Pereira JCG, Catlow CRA, Price GD
3268 - 3284	Ab initio studies of silica-based clusters. Part II. Structures and energies of complex clusters Pereira JCG, Catlow CRA, Price GD
3285 - 3288	Small charged water clusters: Cations Novakovskaya YV, Stepanov NF
3289 - 3293	Ab initio study on the keto-enol tautomerism of the alpha-substituted acetaldehydes XH2CCH=O (X = H, BH2, CH3, NH2, OH, F, CN, NC, and Cl): Comparison with the tautomerism in alpha-substituted acetaldimines and acetyl derivatives Su CC, Lin CK, Wu CC, Lien MH
3294 - 3301	Electron-spin magnetic moments (g factors) of the oxides LiO, NaO, and the superoxides LiO2, NaO2. An ab initio study Bruna PJ, Grein F
3302 - 3309	Geometry and tautomerism of 26,28-dioxasapphyrin and 26,28-dithiasapphyrin: DFT studies Szterenberg L, Latos-Grazynski L
3310 - 3320	Theoretical study of the reaction of Si+ with C3H2 Redondo P, Saguillo A, Barrientos C, Largo A
3321 - 3329	Divide and conquer interaction energy decomposition van der Vaart A, Merz KM
3330 - 3335	A Gaussian-2 study of isomeric C2H2N and C2H2N+ Lau KC, Li WK, Ng CY, Chiu SW
3336 - 3345	Ground and low-lying states of the vanadium boride cation, VB+: An ab initio investigation Kalemos A, Mavridis A
3346 - 3346	Nature of the "extreme conditions" in single sonoluminescing bubbles (vol 100, pg 12140, 1996) Lepoint-Mullie F, De Pauw D, Lepoint T, Supiot P, Avni R