| On evaluating the reaction path Hamiltonian M Page, JW McIver Jr The Journal of chemical physics 88 (2), 922-935, 1988 | 736 | 1988 |
| Following steepest descent reaction paths. The use of higher energy derivatives with ab initio electronic structure methods M Page, C Doubleday, JW McIver Jr The Journal of chemical physics 93 (8), 5634-5642, 1990 | 210 | 1990 |
| Multireference CI gradients and MCSCF second derivatives M Page, P Saxe, GF Adams, BH Lengsfield The Journal of chemical physics 81 (1), 434-439, 1984 | 131 | 1984 |
| Direct Dynamics Quasiclassical Trajectory Study of the Stereochemistry of the Vinylcyclopropane− Cyclopentene Rearrangement C Doubleday, M Nendel, KN Houk, D Thweatt, M Page Journal of the American Chemical Society 121 (19), 4720-4721, 1999 | 99 | 1999 |
| Theoretical investigation of competing mechanisms in the thermal unimolecular decomposition of acetic acid and the hydration reaction of ketene X Duan, M Page Journal of the American Chemical Society 117 (18), 5114-5119, 1995 | 83 | 1995 |
| Ab initio variational transition‐state‐theory reaction‐rate calculations for the gas‐phase reaction H+HNO→H2+NO MR Soto, M Page The Journal of chemical physics 97 (10), 7287-7296, 1992 | 79 | 1992 |
| An ab Initio Study of the Transition State and Forward and Reverse Rate Constants for C2H5 ⇌ H + C2H4 WL Hase, HB Schlegel, V Balbyshev, M Page The Journal of Physical Chemistry 100 (13), 5354-5361, 1996 | 77 | 1996 |
| Chemistry of triplet vs. singlet biradicals. An ab initio MCSCF study of trimethylene C Doubleday Jr, JW McIver Jr, M Page Journal of the American Chemical Society 104 (24), 6533-6542, 1982 | 75 | 1982 |
| Kinetics of the methoxy radical decomposition reaction: Theory and experiment M Page, MC Lin, Y He, TK Choudhury The Journal of Physical Chemistry 93 (11), 4404-4408, 1989 | 72 | 1989 |
| Hydrogen abstraction from a diamond surface. Ab initio quantum chemical study with constrained isobutane as a model M Page, DW Brenner Journal of the American Chemical Society 113 (9), 3270-3274, 1991 | 71 | 1991 |
| Theoretical calculations of the thermal rate constants for the gas-phase chemical reactions H+ NH3⇔ H2+ NH2 and D+ ND3⇔ D2+ ND2. BC Garrett, ML Koszykowski, CF Melius, M Page Journal of Physical Chemistry 94 (18), 7096-7106, 1990 | 71 | 1990 |
| Singlet biradicals as intermediates. Canonical variational transition-state theory results for trimethylene C Doubleday Jr, JW McIver Jr, M Page The Journal of Physical Chemistry 92 (15), 4367-4371, 1988 | 70 | 1988 |
| Computing reaction pathways on molecular potential energy surfaces ML Mckee, M Page Reviews in computational chemistry 4, 35-65, 2007 | 67 | 2007 |
| Is tetramethylene an intermediate? C Doubleday Jr, RN Camp, HF King, JW McIver Jr, D Mullally, M Page Journal of the American Chemical Society 106 (2), 447-448, 1984 | 67 | 1984 |
| Thermal rate constants for R+ N2H2→ RH+ N2H (R= H, OH, NH2) determined from multireference configuration interaction and variational transition state theory calculations DP Linder, X Duan, M Page The Journal of chemical physics 104 (16), 6298-6307, 1996 | 52 | 1996 |
| Dimerization energy of borane M Page, GF Adams, JS Binkley, CF Melius Journal of Physical Chemistry 91 (11), 2675-2678, 1987 | 47 | 1987 |
| Multireference configuration interaction study of the reaction hydrogen+ boron monoxide. fwdarw. atomic hydrogen+ oxoborane (hbo) M Page The Journal of Physical Chemistry 93 (9), 3639-3643, 1989 | 44 | 1989 |
| Ab initio variational transition state theory calculations for the H+ NH2. tautm. H2+ NH hydrogen abstraction reaction on the triplet potential energy surface DP Linder, X Duan, M Page The Journal of Physical Chemistry 99 (29), 11458-11463, 1995 | 39 | 1995 |
| A b initio multireference configuration interaction study of CH2NNO2. HONO elimination vs NN bond fragmentation RC Mowrey, M Page, GF Adams, BH Lengsfield III The Journal of chemical physics 93 (3), 1857-1864, 1990 | 36 | 1990 |
| Classical dynamics simulations of unimolecular decomposition of CH2NNO2: HONO elimination vs NN bond scission BM Rice, GF Adams, M Page, DL Thompson The Journal of Physical Chemistry 99 (14), 5016-5028, 1995 | 33 | 1995 |
D W BrennerProfessor at North Carolina State UniversityVerified email at ncsu.edu
D W BrennerProfessor at North Carolina State UniversityVerified email at ncsu.edu