9045 - 9050 |
Kinetic model for determination of reaction and polarization dynamics from chemically induced electron spin polarized electron spin resonance spectra Adrian FJ |
9051 - 9058 |
Vibrational mode coupling to ultrafast electron transfer in [(CN)(5)OsCNRu(NH3)(5)](-) studied by femtosecond infrared spectroscopy Tivansky AV, Wang CF, Walker GC |
9059 - 9069 |
Semiclassical theory of vibrational energy relaxation in the condensed phase Shi Q, Geva E |
9070 - 9078 |
Vibrational energy relaxation in liquid oxygen from a semiclassical molecular dynamics simulation Shi Q, Geva E |
9079 - 9085 |
Photochemical isomerization of colchicine and thiocolchicine Bussotti L, Cacelli I, D'Auria M, Foggi P, Lesma G, Silvani A, Villani V |
9086 - 9098 |
Electron paramagnetic resonance line shifts and line shape changes due to spin exchange between nitroxide free radicals in liquids. 3. Extension to five hyperfine lines. Additional line shifts due to re-encounters Bales BL, Peric M |
9099 - 9104 |
Solvation of yttrium with ammonia: An experimental and theoretical study Simard B, Rayner DM, Benichou E, Mireles N, Tenorio FJ, Martinez A |
9105 - 9112 |
Absolute resonance Raman intensity analysis of isopropyl nitrate in the condensed phase McLaughlin RP, Nyholm BP, Reid PJ |
9113 - 9131 |
Multidimensional infrared signatures of intramolecular hydrogen bonding in malonaldehyde Hayashi T, Mukamel S |
9132 - 9136 |
Wide-temperature-range kinetics of the reactions of Cu with Cl-2 and N2O and of CuCl with Cl-2 Cosic B, Belyung DP, Hranisavljevic J, Fontijn A |
9137 - 9146 |
Determination of the rate constant for the radical-radical reaction CN(X-2 Sigma(+))+OH(X-2 Pi) at 292 K Decker BK, Macdonald RG |
9147 - 9159 |
Ab initio calculations for hydrocarbons: Enthalpy of formation, transition state geometry, and activation energy for radical reactions Saeys M, Reyniers MF, Marin GB |
9160 - 9167 |
Manifestations of symmetry breaking in self-consistent field electronic structure calculations Dunietz BD, Head-Gordon M |
9168 - 9174 |
Ab initio characterization of ClNO3 isomers Lesar A, Prebil S, Hodoscek M |
9175 - 9181 |
Quantifying the role of water in protein-carbohydrate interactions Tschampel SM, Woods RJ |
9182 - 9188 |
The S-H bond dissociation enthalpies and acidities of para and meta substituted thiophenols: A quantum chemical study Chandra AK, Nam PC, Nguyen MT |
9189 - 9196 |
Gas-phase reactions between silane and ammonia: A theoretical study Hu SW, Wang Y, Wang XY, Chu TW, Liu XQ |
9197 - 9207 |
Solvent effects on the energetics of the phenol O-H bond: Differential solvation of phenol and phenoxy radical in benzene and acetonitrile Guedes RC, Coutinho K, Cabral BJC, Canuto S, Correia CF, dos Santos RMB, Simoes JAM |
9208 - 9220 |
Conformational analysis of glutathione in aqueous solution with molecular dynamics Lampela O, Juffer AH, Rauk A |
9221 - 9231 |
Hydrogen atom addition to cytosine, 1-methylcytosine, and cytosine-water complexes. A computational study of a mechanistic dichotomy Turecek F, Yao CX |
9232 - 9239 |
Bifurcated hydrogen bonds in crystal structures of new phosphorochromone derivatives Rybarczyk-Pirek AJ, Grabowski SJ, Nawrot-Modranka J |
9240 - 9247 |
Radical yields in the radiolysis of branched hydrocarbons: Tertiary C-H bond rupture in 2,3-dimethylbutane, 2,4-dimethylpentane, and 3-ethylpentane Schuler RH, Wojnarovits L |
9248 - 9248 |
Comment on "Kinetics of a Diels-Alder reaction of maleic anhydride and isoprene in supercritical CO2" Alexander GC, Paulaitis ME |
9249 - 9249 |
Reply to comment on "Kinetics of a Diels-Alder reaction of maleic anhydride and isoprene in supercritical CO2" Glebov EM, Krishtopa LG, Stepanov V, Krasnoperov LN |
9250 - 9250 |
Comment on "Rationalizing the strength of hydrogen-bonded complexes. Ab initio HF and DFT studies" Schneider HJ |
9251 - 9252 |
Reply to comment on "Rationalizing the strength of hydrogen-bonded complexes. Ab initio HF and DFT studies" Lukin O, Leszczynski J |