| 9761 - 9765 |
Excited States of DNA Base Pairs Using Long-Range Corrected Time-Dependent Density Functional Theory
Jensen L, Govind N |
| 9766 - 9771 |
Cooperative Effect of Hydrogen-Bonded Chains in the Environment of pi -> pi* Chromophore
Fradelos G, Kaminski JW, Wesolowski TA, Leutwyler S |
| 9772 - 9778 |
Kinetic Study of Hydrodechlorination of Chlorobiphenyl with Polymer-Stabilized Palladium Nanoparticles in Supercritical Carbon Dioxide
Liao WS, Pan HB, Liu HW, Chen HJ, Wai CM |
| 9779 - 9791 |
Photoreactivity of a Push-Pull Merocyanine in Static Electric Fields: A Three-State Model of Isomerization Reactions Involving Conical Intersections
Xu XF, Kahan A, Zilberg S, Haas Y |
| 9792 - 9803 |
Coherent Multidimensional Vibrational Spectroscopy of Representative N-Alkanes
Mathew NA, Rickard MA, Kornau KM, Pakoulev AV, Block SB, Yurs LA, Wright JC |
| 9804 - 9813 |
Structural Evolution, Sequential Oxidation, and Chemical Bonding in Tritantalum Oxide Clusters: Ta3On- and Ta3On (n=1-8)
Zhai HJ, Wang B, Huang X, Wang LS |
| 9814 - 9824 |
Kinetics of the Gas-Phase Reactions of OH and NO3 Radicals and O-3 with Allyl Alcohol and Allyl Isocyanate
Parker JK, Espada-Jallad C |
| 9825 - 9833 |
Can the C5H5 + C5H5 -> C10H10 -> C10H9 + H/C10H8 + H-2 Reaction Produce Naphthalene? An Ab Initio/RRKM Study
Mebel AM, Kislov VV |
| 9834 - 9842 |
Perfluorinated Surfactant Chain-Length Effects on Sonochemical Kinetics
Campbell TY, Vecitis CD, Mader BT, Hoffmann MR |
| 9843 - 9851 |
Assessment of the "6-31+G**+LANL2DZ" Mixed Basis Set Coupled with Density Functional Theory Methods and the Effective Core Potential: Prediction of Heats of Formation and Ionization Potentials for First-Row-Transition-Metal Complexes
Yang Y, Weaver MN, Merz KM |
| 9852 - 9860 |
Mechanism and Dynamic Correlation Effects in Cycloaddition Reactions of Singlet Difluorocarbene to Alkenes and Disilene
Gao XF, Ohtsuka Y, Ishimura K, Nagase S |
| 9861 - 9873 |
Optimization and Basis-Set Dependence of a Restricted-Open-Shell Form of B2-PLYP Double-Hybrid Density Functional Theory
Graham DC, Menon AS, Goerigk L, Grimme S, Radom L |
| 9874 - 9880 |
Qualitative Study of Substituent Effects on NMR N-15 and O-17 Chemical Shifts
Contreras RH, Llorente T, Pagola GI, Bustamante MG, Pasqualini EE, Melo JI, Tormena CF |
| 9881 - 9890 |
Ab Initio Study of the Electron Transfer in an Ionized Stacked Complex of Guanines
Cauet E, Lievin J |
| 9891 - 9898 |
C-70 Oxides and Ozonides and the Mechanism of Ozonolysis on the Fullerene Surface. A Theoretical Study
Bil A, Latajka Z, Morrison CA |
| 9899 - 9907 |
Density Functional Theory Study of the Stability and Vibrational Spectra of the beta-Carotene Isomers
Ceron-Carrasco JP, Bastida A, Zuniga J, Requena A, Miguel B |
| 9908 - 9919 |
Conformational and Substitution Effects on the Electron Distribution in a Series of Anthocyanidins
Estevez L, Mosquera RA |
| 9920 - 9933 |
Microsolvation of Thiosulfuric Acid and Its Tautomeric Anions [HSSO3](-) and [SSO2(OH)](-) Studied by B3LYP-PCM and G3X(MP2) Calculations
Steudel R, Steudel Y |
| 9934 - 9944 |
Fluoxetine and Norfluoxetine Revisited: New Insights into the Electrochemical and Spectroscopic Properties
Garrido EM, Garrido J, Calheiros R, Marques MPM, Borges F |
