| Catalysis research of relevance to carbon management: progress, challenges, and opportunities H Arakawa, M Aresta, JN Armor, MA Barteau, EJ Beckman, AT Bell, ... Chemical reviews 101 (4), 953-996, 2001 | 1650 | 2001 |
| Ionization potential, electron affinity, electronegativity, hardness, and electron excitation energy: molecular properties from density functional theory orbital energies CG Zhan, JA Nichols, DA Dixon The Journal of Physical Chemistry A 107 (20), 4184-4195, 2003 | 1482 | 2003 |
| Parallel Douglas–Kroll energy and gradients in NWChem: Estimating scalar relativistic effects using Douglas–Kroll contracted basis sets WA De Jong, RJ Harrison, DA Dixon The Journal of Chemical Physics 114 (1), 48-53, 2001 | 988 | 2001 |
| A local density functional study of the structure and vibrational frequencies of molecular transition-metal compounds C Sosa, J Andzelm, BC Elkin, E Wimmer, KD Dobbs, DA Dixon The Journal of Physical Chemistry 96 (16), 6630-6636, 1992 | 889 | 1992 |
| Role of water in electron-initiated processes and radical chemistry: Issues and scientific advances BC Garrett, DA Dixon, DM Camaioni, DM Chipman, MA Johnson, ... Chemical reviews 105 (1), 355-390, 2004 | 702 | 2004 |
| From molecules to materials: Current trends and future directions P Alivisatos, PF Barbara, AW Castleman, J Chang, DA Dixon, ML Klein, ... Advanced Materials 10 (16), 1297-1336, 1998 | 604 | 1998 |
| Hydrogen bond energy of the water dimer MW Feyereisen, D Feller, DA Dixon The Journal of Physical Chemistry 100 (8), 2993-2997, 1996 | 570 | 1996 |
| On the enthalpy of formation of hydroxyl radical and gas-phase bond dissociation energies of water and hydroxyl B Ruscic, AF Wagner, LB Harding, RL Asher, D Feller, DA Dixon, ... The Journal of Physical Chemistry A 106 (11), 2727-2747, 2002 | 533 | 2002 |
| Chemical accuracy in ab initio thermochemistry and spectroscopy: current strategies and future challenges KA Peterson, D Feller, DA Dixon Theoretical Chemistry Accounts 131, 1-20, 2012 | 497 | 2012 |
| On a quantitative scale for Lewis acidity and recent progress in polynitrogen chemistry KO Christe, DA Dixon, D McLemore, WW Wilson, JA Sheehy, JA Boatz Journal of Fluorine Chemistry 101 (2), 151-153, 2000 | 478 | 2000 |
| Regeneration of ammonia borane spent fuel by direct reaction with hydrazine and liquid ammonia AD Sutton, AK Burrell, DA Dixon, EB Garner III, JC Gordon, T Nakagawa, ... Science 331 (6023), 1426-1429, 2011 | 471 | 2011 |
| How Strong Is the Cα−H···OC Hydrogen Bond? R Vargas, J Garza, DA Dixon, BP Hay Journal of the American Chemical Society 122 (19), 4750-4755, 2000 | 464 | 2000 |
| Acid initiation of ammonia–borane dehydrogenation for hydrogen storage FH Stephens, RT Baker, MH Matus, DJ Grant, DA Dixon Angewandte Chemie International Edition 46 (5), 746-749, 2007 | 456 | 2007 |
| Photoelectron spectroscopy of a carbene/silylene/germylene series AJ Arduengo III, H Bock, H Chen, M Denk, DA Dixon, JC Green, ... Journal of the American Chemical Society 116 (15), 6641-6649, 1994 | 422 | 1994 |
| A survey of factors contributing to accurate theoretical predictions of atomization energies and molecular structures D Feller, KA Peterson, DA Dixon The Journal of chemical physics 129 (20), 2008 | 405 | 2008 |
| Absolute hydration free energy of the proton from first-principles electronic structure calculations CG Zhan, DA Dixon The Journal of Physical Chemistry A 105 (51), 11534-11540, 2001 | 364 | 2001 |
| 13C NMR Spectroscopy of “Arduengo-type” Carbenes and Their Derivatives D Tapu, DA Dixon, C Roe Chemical reviews 109 (8), 3385-3407, 2009 | 360 | 2009 |
| Electronic structure of a stable nucleophilic carbene DA Dixon, AJ Arduengo III The Journal of Physical Chemistry 95 (11), 4180-4182, 1991 | 320 | 1991 |
| Extended benchmark studies of coupled cluster theory through triple excitations D Feller, DA Dixon The Journal of Chemical Physics 115 (8), 3484-3496, 2001 | 309 | 2001 |
| Electron distribution in a stable carbene AJ Arduengo III, HVR Dias, DA Dixon, RL Harlow, WT Klooster, ... Journal of the American Chemical Society 116 (15), 6812-6822, 1994 | 299 | 1994 |
