| Perturbative perspectives on the chemical reaction prediction problem PW Ayers, JSM Anderson, LJ Bartolotti International Journal of Quantum Chemistry 101 (5), 520-534, 2005 | 532 | 2005 |
| Highly luminescent tetradentate bis-cyclometalated platinum complexes: design, synthesis, structure, photophysics, and electroluminescence application DAK Vezzu, JC Deaton, JS Jones, L Bartolotti, CF Harris, AP Marchetti, ... Inorganic chemistry 49 (11), 5107-5119, 2010 | 333 | 2010 |
| Epoxide as a precursor to secondary organic aerosol formation from isoprene photooxidation in the presence of nitrogen oxides YH Lin, H Zhang, HOT Pye, Z Zhang, WJ Marth, S Park, M Arashiro, T Cui, ... Proceedings of the National Academy of Sciences 110 (17), 6718-6723, 2013 | 296 | 2013 |
| An introduction to density functional theory LJ Bartolotti, K Flurchick Reviews in computational chemistry, 187-216, 1996 | 269 | 1996 |
| On the geometric mean principle for electronegativity equalization RG Parr, LJ Bartolotti Journal of the American Chemical Society 104 (14), 3801-3803, 1982 | 258 | 1982 |
| Some remarks on the density functional theory of few-electron systems RG Parr, LJ Bartolotti The Journal of Physical Chemistry 87 (15), 2810-2815, 1983 | 213 | 1983 |
| Local density functional theory of atoms and molecules RG Parr, SR Gadre, LJ Bartolotti Proceedings of the National Academy of Sciences 76 (6), 2522-2526, 1979 | 182 | 1979 |
| Time-dependent extension of the Hohenberg-Kohn-Levy energy-density functional LJ Bartolotti Physical Review A 24 (4), 1661, 1981 | 157 | 1981 |
| An atomic model for the pleated β-sheet structure of Aβ amyloid protofilaments L Li, TA Darden, L Bartolotti, D Kominos, LG Pedersen Biophysical Journal 76 (6), 2871-2878, 1999 | 155 | 1999 |
| Time-dependent Kohn-Sham density-functional theory LJ Bartolotti Physical Review A 26 (4), 2243, 1982 | 140 | 1982 |
| An atomic kinetic energy functional with full Weizsacker correction PK Acharya, LJ Bartolotti, SB Sears, RG Parr Proceedings of the National Academy of Sciences 77 (12), 6978-6982, 1980 | 140 | 1980 |
| Electronegativities, electron affinities, ionization potentials, and hardnesses of the elements within spin polarized density functional theory J Robles, LJ Bartolotti Journal of the American Chemical Society 106 (13), 3723-3727, 1984 | 137 | 1984 |
| Electronegativities of the elements from simple. CHI.. alpha. theory LJ Bartolotti, SR Gadre, RG Parr Journal of the American Chemical Society 102 (9), 2945-2948, 1980 | 126 | 1980 |
| Intramolecular hydrogen bonding and cooperative interactions in carbohydrates via the molecular tailoring approach MM Deshmukh, LJ Bartolotti, SR Gadre The Journal of Physical Chemistry A 112 (2), 312-321, 2008 | 118 | 2008 |
| An example where orbital relaxation is an important contribution to the Fukui function LJ Bartolotti, PW Ayers The Journal of Physical Chemistry A 109 (6), 1146-1151, 2005 | 112 | 2005 |
| Chiral dipole-stabilized anions: experiment and theory in nonbenzylic systems. 100 Percent stereoselective deprotonation and two-electron versus single-electron transfer in the … RE Gawley, GC Hart, LJ Bartolotti The Journal of Organic Chemistry 54 (1), 175-181, 1989 | 100 | 1989 |
| Estimation of intramolecular hydrogen bond energy via molecular tailoring approach MM Deshmukh, SR Gadre, LJ Bartolotti The Journal of Physical Chemistry A 110 (45), 12519-12523, 2006 | 97 | 2006 |
| Charge density and chemical reactions: a unified view from conceptual DFT PA Johnson, LJ Bartolotti, PW Ayers, T Fievez, P Geerlings Modern charge-density analysis, 715-764, 2011 | 90 | 2011 |
| Density functional theory derived intermediates from the OH initiated atmospheric oxidation of toluene LJ Bartolotti, EO Edney Chemical Physics Letters 245 (1), 119-122, 1995 | 89 | 1995 |
| The concept of pressure in density functional theory LJ Bartolotti, RG Parr The Journal of Chemical Physics 72 (3), 1593-1596, 1980 | 89 | 1980 |
