Tom Cundari
Tom Cundari
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Effective core potential methods for the lanthanides
TR Cundari, WJ Stevens
The Journal of chemical physics 98 (7), 5555-5565, 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
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
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
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
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
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
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
Reviews in Computational Chemistry 6
KB Lipkowitz, DB Boyd
VCH, 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
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
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
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
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
Computational studies of transition metal− main group multiple bonding
TR Cundari
Chemical Reviews 100 (2), 807-818, 2000
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
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
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
Transition metal imido complexes
TR Cundari
Journal of the American Chemical Society 114 (20), 7879-7888, 1992
Principal resonance contributors to high-valent, transition-metal alkylidene complexes
TR Cundari, MS Gordon
Journal of the American Chemical Society 113 (14), 5231-5243, 1991
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