| 1 |
Theoretical study of the microsolvation of the bromide anion in water, methanol, and acetonitrile: Ion-solvent vs solvent-solvent interactions
Ayala R, Martinez JM, Pappalardo RR, Marcos ES
Journal of Physical Chemistry A, 104(12), 2799, 2000 |
| 2 |
Vibrational spectroscopy of small Br-center dot(H2O)(n) and I-center dot(H2O)(n) clusters : Infrared characterization of the ionic hydrogen bond
Ayotte P, Bailey CG, Weddle GH, Johnson MA
Journal of Physical Chemistry A, 102(18), 3067, 1998 |
| 3 |
Deprotonating molecules and free radicals to form carbon-centered anions : A G2 ab initio study of molecular and free radical acidity
Mayer PM, Radom L
Journal of Physical Chemistry A, 102(25), 4918, 1998 |
| 4 |
Thermochemistry of CH3CN, CH3NC, and their cyclic isomers and related radicals, cations, and anions : Some curious discrepancies between theory and experiment
Mayer PM, Taylor MS, Wong MW, Radom L
Journal of Physical Chemistry A, 102(35), 7074, 1998 |
| 5 |
Heats of Formation of Alkyl Fluorides
Luo YR, Benson SW
Journal of Physical Chemistry A, 101(16), 3042, 1997 |
| 6 |
C-H bond dissociation energies of alkyl amines: Radical structures and stabilization energies
Wayner DDM, Clark KB, Rauk A, Yu D, Armstrong DA
Journal of the American Chemical Society, 119(38), 8925, 1997 |
| 7 |
On the Relevance of the Parr-Pearson Principle of Absolute Hardness to Organic-Chemistry
Arnett EM, Ludwig RT
Journal of the American Chemical Society, 117(24), 6627, 1995 |
| 8 |
Homolytic Bond-Dissociation Enthalpies of the Acidic H-A Bonds Caused by Proximate Substituents in Sets of Methyl Ketones, Carboxylic Esters, and Carboxamides Related to Changes in-Ground State Energies
Bordwell FG, Zhang SZ, Zhang XM, Liu WZ
Journal of the American Chemical Society, 117(27), 7092, 1995 |
| 9 |
Theoretical Resonance Energies of Benzene, Cyclobutadiene, and Butadiene
Mo YR, Wu W, Zhang QN
Journal of Physical Chemistry, 98(40), 10048, 1994 |
| 10 |
Assessment of the Importance of Changes in Ground-State Energies on the Bond-Dissociation Enthalpies of the O-H Bonds in Phenols and the S-H Bonds in Thiophenols
Bordwell FG, Zhang XM, Satish AV, Cheng JP
Journal of the American Chemical Society, 116(15), 6605, 1994 |
