| Effective core potential methods for the lanthanides TR Cundari, WJ Stevens The Journal of chemical physics 98 (7), 5555-5565, 1993 | 1518 | 1993 |
| Studies of low-coordinate iron dinitrogen complexes JM Smith, AR Sadique, TR Cundari, KR Rodgers, G Lukat-Rodgers, ... Journal of the American Chemical Society 128 (3), 756-769, 2006 | 366 | 2006 |
| Copper–nitrene complexes in catalytic C–H amination YM Badiei, A Dinescu, X Dai, RM Palomino, FW Heinemann, TR Cundari, ... Angew. Chem., Int. Ed 47 (51), 9961-9964, 2008 | 357 | 2008 |
| The correlation consistent composite approach (ccCA): An alternative to the Gaussian-n methods NJ DeYonker, TR Cundari, AK Wilson The Journal of chemical physics 124 (11), 2006 | 354 | 2006 |
| CO2 Reduction on Transition Metal (Fe, Co, Ni, and Cu) Surfaces: In Comparison with Homogeneous Catalysis C Liu, TR Cundari, AK Wilson The Journal of Physical Chemistry C 116 (9), 5681-5688, 2012 | 353 | 2012 |
| Stepwise reduction of dinitrogen bond order by a low-coordinate iron complex JM Smith, RJ Lachicotte, KA Pittard, TR Cundari, G Lukat-Rodgers, ... Journal of the American Chemical Society 123 (37), 9222-9223, 2001 | 322 | 2001 |
| Metal effect on the supramolecular structure, photophysics, and acid− base character of trinuclear pyrazolato coinage metal complexes MA Omary, MA Rawashdeh-Omary, MWA Gonser, O Elbjeirami, T Grimes, ... Inorganic chemistry 44 (23), 8200-8210, 2005 | 320 | 2005 |
| Electronically unsaturated three-coordinate chloride and methyl complexes of iron, cobalt, and nickel PL Holland, TR Cundari, LL Perez, NA Eckert, RJ Lachicotte Journal of the American Chemical Society 124 (48), 14416-14424, 2002 | 277 | 2002 |
| Reviews in Computational Chemistry 6 KB Lipkowitz, DB Boyd VCH, 1995 | 233 | 1995 |
| Ru (II) catalysts supported by hydridotris (pyrazolyl) borate for the hydroarylation of olefins: reaction scope, mechanistic studies, and guides for the development of improved … NA Foley, JP Lee, Z Ke, TB Gunnoe, TR Cundari Accounts of chemical research 42 (5), 585-597, 2009 | 207 | 2009 |
| The reactivity patterns of low-coordinate iron− hydride complexes Y Yu, AR Sadique, JM Smith, TR Dugan, RE Cowley, WW Brennessel, ... Journal of the American Chemical Society 130 (20), 6624-6638, 2008 | 206 | 2008 |
| Catalytic C H Amination with Unactivated Amines through Copper (II) Amides S Wiese, YM Badiei, RT Gephart, S Mossin, MS Varonka, MM Melzer, ... Angewandte Chemie 122 (47), 9034-9039, 2010 | 202 | 2010 |
| Quantitative computational thermochemistry of transition metal species NJ DeYonker, KA Peterson, G Steyl, AK Wilson, TR Cundari The Journal of Physical Chemistry A 111 (44), 11269-11277, 2007 | 189 | 2007 |
| A two-coordinate nickel imido complex that effects C− H amination CA Laskowski, AJM Miller, GL Hillhouse, TR Cundari Journal of the American Chemical Society 133 (4), 771-773, 2011 | 186 | 2011 |
| Coordination‐Number Dependence of Reactivity in an Imidoiron (III) Complex NA Eckert, S Vaddadi, S Stoian, RJ Lachicotte, TR Cundari, PL Holland Angewandte Chemie 118 (41), 7022-7025, 2006 | 177 | 2006 |
| Computational studies of transition metal− main group multiple bonding TR Cundari Chemical Reviews 100 (2), 807-818, 2000 | 177 | 2000 |
| An intermediate neglect of differential overlap model for second‐row transition metal species WP Anderson, TR Cundari, MC Zerner International journal of quantum chemistry 39 (1), 31-45, 1991 | 176 | 1991 |
| The correlation-consistent composite approach: Application to the G3/99 test set NJ DeYonker, T Grimes, S Yockel, A Dinescu, B Mintz, TR Cundari, ... The Journal of chemical physics 125 (10), 2006 | 172 | 2006 |
| Transition metal imido complexes TR Cundari Journal of the American Chemical Society 114 (20), 7879-7888, 1992 | 165 | 1992 |
| Reaction of CuI with Dialkyl Peroxides: CuII-Alkoxides, Alkoxy Radicals, and Catalytic C–H Etherification RT Gephart III, CL McMullin, NG Sapiezynski, ES Jang, MJB Aguila, ... Journal of the American Chemical Society 134 (42), 17350-17353, 2012 | 159 | 2012 |