| Gaussian 03, revision c. 02, Gaussian M Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Wallingford, CT 4, 2004 | 56909 | 2004 |
| Gaussian 98, revision a. 7, Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Pittsburgh, PA 12, 1998 | 16296 | 1998 |
| Gaussian 94, Version B1 and D4; Gaussian MJ Frisch, GW Trucks, HB Schlegel, PMW Gill, BG Johnson, MA Robb, ... Inc.: Pittsburgh, PA, 1995 | 5425* | 1995 |
| Advances in molecular quantum chemistry contained in the Q-Chem 4 program package Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ... Molecular Physics 113 (2), 184-215, 2015 | 3046 | 2015 |
| Advances in methods and algorithms in a modern quantum chemistry program package Y Shao, LF Molnar, Y Jung, J Kussmann, C Ochsenfeld, ST Brown, ... Physical Chemistry Chemical Physics 8 (27), 3172-3191, 2006 | 2915 | 2006 |
| Gaussian 03, Revision C. 02. Wallingford, CT: Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc.[Google Scholar], 2004 | 2738 | 2004 |
| The performance of a family of density functional methods BG Johnson, PMW Gill, JA Pople The Journal of chemical physics 98 (7), 5612-5626, 1993 | 2207 | 1993 |
| The performance of the Becke—Lee—Yang—Parr (B—LYP) density functional theory with various basis sets PMW Gill, BG Johnson, JA Pople, MJ Frisch Chemical Physics Letters 197 (4-5), 499-505, 1992 | 1046 | 1992 |
| Q‐Chem 2.0: a high‐performance ab initio electronic structure program package J Kong, CA White, AI Krylov, D Sherrill, RD Adamson, TR Furlani, MS Lee, ... Journal of Computational Chemistry 21 (16), 1532-1548, 2000 | 685 | 2000 |
| Gaussian 03, Revision C. 02. Gaussian KN Kudin, JC Burant, JM Millam, SS Iyengar, J Tomasi, V Barone, ... Inc, 2004 | 674 | 2004 |
| Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package E Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ... The Journal of chemical physics 155 (8), 2021 | 669 | 2021 |
| Kohn—Sham density-functional theory within a finite basis set JA Pople, PMW Gill, BG Johnson Chemical physics letters 199 (6), 557-560, 1992 | 646 | 1992 |
| Gaussian 03, revision c. 02; gaussian, inc.: Wallingford, ct, 2004 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Google Scholar There is no corresponding record for this reference, 2013 | 576 | 2013 |
| A standard grid for density functional calculations PMW Gill, BG Johnson, JA Pople Chemical Physics Letters 209 (5-6), 506-512, 1993 | 565 | 1993 |
| Self-consistent field calculations of excited states using the maximum overlap method (MOM) ATB Gilbert, NA Besley, PMW Gill The Journal of Physical Chemistry A 112 (50), 13164-13171, 2008 | 560 | 2008 |
| gaussian 92/dft MJ Frisch, GW Trucks, HB Schlegel, PMW Gill, BG Johnson, MW Wong, ... Revision F 2, 1993 | 502 | 1993 |
| The continuous fast multipole method CA White, BG Johnson, PMW Gill, M Head-Gordon Chemical physics letters 230 (1-2), 8-16, 1994 | 474 | 1994 |
| JA Gaussian 03, Revision C. 02; Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc.: Wallingford, CT, 2004 | 458 | 2004 |
| A density functional study of the simplest hydrogen abstraction reaction. Effect of self-interaction correction BG Johnson, CA Gonzales, PMW Gill, JA Pople Chemical physics letters 221 (1-2), 100-108, 1994 | 413 | 1994 |
| Gaussian 09 Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford CT, Revision A 1, 2009 | 393* | 2009 |
