| Handbook of Gaussian basis sets R Poirier, R Kari, IG Csizmadia | 536 | 1985 |
| Comparison of geometries and electronic structures of polyacetylene, polyborole, polycyclopentadiene, polypyrrole, polyfuran, polysilole, polyphosphole, polythiophene … U Salzner, JB Lagowski, PG Pickup, RA Poirier Synthetic Metals 96 (3), 177-189, 1998 | 484 | 1998 |
| Cumulative atomic multipole representation of the molecular charge distribution and its basis set dependence WA Sokalski, RA Poirier Chemical Physics Letters 98 (1), 86-92, 1983 | 222 | 1983 |
| Design of low band gap polymers employing density functional theory—hybrid functionals ameliorate band gap problem U Salzner, JB Lagowski, PG Pickup, RA Poirier Journal of computational chemistry 18 (15), 1943-1953, 1997 | 199 | 1997 |
| Accurate method for obtaining band gaps in conducting polymers using a DFT/hybrid approach U Salzner, PG Pickup, RA Poirier, JB Lagowski The Journal of Physical Chemistry A 102 (15), 2572-2578, 1998 | 198 | 1998 |
| Bonding between nonbonded sulfur and oxygen atoms in selected organic molecules (a quantum chemical study) JG Angyan, RA Poirier, A Kucsman, IG Csizmadia Journal of the American Chemical Society 109 (8), 2237-2245, 1987 | 149 | 1987 |
| A Theoretical Study of the Relationship between Secondary. alpha.-Deuterium Kinetic Isotope Effects and the Structure of SN2 Transition States RA Poirier, Y Wang, KC Westaway Journal of the American Chemical Society 116 (6), 2526-2533, 1994 | 122 | 1994 |
| Program Monstergauss MR Peterson, RA Poirier University of Toronto, Canada, 1980 | 99 | 1980 |
| MonsterGauss M Peterson, RA Poirier Department of Chemistry, University of Toronto, Toronto, Canada, 1980 | 96 | 1980 |
| The isomers of Si2H4: disilene and silylsilylene RA Poirier, JD Goddard Chemical Physics Letters 80 (1), 37-41, 1981 | 88 | 1981 |
| An ab initio investigation of lithium ion hydration CC Pye, W Rudolph, RA Poirier The Journal of Physical Chemistry 100 (2), 601-605, 1996 | 83 | 1996 |
| Spectroscopy of the transition state (theory). II. Absorption by H‡3 in H+H2→H‡3→H2+H HR Mayne, RA Poirier, JC Polanyi The Journal of chemical physics 80 (9), 4025-4034, 1984 | 69 | 1984 |
| Computational Study of the Deamination Reaction of Cytosine with H2O and OH- MH Almatarneh, CG Flinn, RA Poirier, WA Sokalski The Journal of Physical Chemistry A 110 (26), 8227-8234, 2006 | 65 | 2006 |
| An ab initio study of facial selectivity in the Diels− Alder reaction JD Xidos, RA Poirier, CC Pye, DJ Burnell The Journal of Organic Chemistry 63 (1), 105-112, 1998 | 61 | 1998 |
| Medium effect on the equilibrium geometries, vibrational frequencies and solvation energies of sulfanilamide MA Halim, DM Shaw, RA Poirier Journal of Molecular Structure: THEOCHEM 960 (1-3), 63-72, 2010 | 55 | 2010 |
| MONSTERGAUSS program MR Peterson, RA Poirier, IG Csizmadia University of Toronto, Canada, 1981 | 55 | 1981 |
| Origin of Facial Selectivity in the Diels-Alder Reactions of 5-Substituted 1, 3-Cyclopentadienes RA Poirier, CC Pye, JD Xidos, DJ Burnell The Journal of Organic Chemistry 60 (8), 2328-2329, 1995 | 52 | 1995 |
| The 213.8-nm photochemistry of gaseous 1, 3-butadiene and the structure of some C3H3 radicals GJ Collin, H Deslauriers, GR De Mare, RA Poirier Journal of Physical Chemistry 94 (1), 134-141, 1990 | 51 | 1990 |
| Mechanisms for the Deamination Reaction of Cytosine with H2O/OH− and 2H2O/OH−: A Computational Study MH Almatarneh, CG Flinn, RA Poirier Journal of chemical information and modeling 48 (4), 831-843, 2008 | 50 | 2008 |
| An SCF and CI Study of the 1,3 Shift in the HXCHY⇌XCHYH Isoelectronic Series: X, YCH2, NH, and O RA Poirier, D Majlessi, TJ Zielinski Journal of computational chemistry 7 (4), 464-475, 1986 | 50 | 1986 |
