| On the effectiveness of CCSD (T) complete basis set extrapolations for atomization energies D Feller, KA Peterson, J Grant Hill The Journal of chemical physics 135 (4), 044102, 2011 | 322 | 2011 |
| Extrapolating MP2 and CCSD explicitly correlated correlation energies to the complete basis set limit with first and second row correlation consistent basis sets JG Hill, KA Peterson, G Knizia, HJ Werner The Journal of chemical physics 131 (19), 194105, 2009 | 322 | 2009 |
| Correlation consistent basis sets for molecular core-valence effects with explicitly correlated wave functions: The atoms B–Ne and Al–Ar JG Hill, S Mazumder, KA Peterson The Journal of chemical physics 132 (5), 054108, 2010 | 319 | 2010 |
| Calculation of intermolecular interactions in the benzene dimer using coupled-cluster and local electron correlation methods JG Hill, JA Platts, HJ Werner Physical Chemistry Chemical Physics 8 (35), 4072-4078, 2006 | 274 | 2006 |
| Gaussian basis sets for molecular applications JG Hill International Journal of Quantum Chemistry 113 (1), 21-34, 2013 | 238 | 2013 |
| Gaussian basis sets for use in correlated molecular calculations. XI. Pseudopotential-based and all-electron relativistic basis sets for alkali metal (K–Fr) and alkaline earth … JG Hill, KA Peterson The Journal of Chemical Physics 147 (24), 244106, 2017 | 201 | 2017 |
| Spin-component scaling methods for weak and stacking interactions JG Hill, JA Platts Journal of Chemical Theory and Computation 3 (1), 80-85, 2007 | 172 | 2007 |
| Correlation consistent basis sets for explicitly correlated wavefunctions: valence and core–valence basis sets for Li, Be, Na, and Mg JG Hill, KA Peterson Physical Chemistry Chemical Physics 12 (35), 10460-10468, 2010 | 149 | 2010 |
| Assessment of the Performance of MP2 and MP2 Variants for the Treatment of Noncovalent Interactions KE Riley, JA Platts, J Řezáč, P Hobza, JG Hill The Journal of Physical Chemistry A 116 (16), 4159-4169, 2012 | 139 | 2012 |
| Correlation consistent basis sets for explicitly correlated wavefunctions: Pseudopotential-based basis sets for the post-d main group elements Ga–Rn JG Hill, KA Peterson The Journal of Chemical Physics 141 (9), 094106, 2014 | 98 | 2014 |
| Explicitly correlated composite thermochemistry of transition metal species DH Bross, JG Hill, HJ Werner, KA Peterson The Journal of chemical physics 139 (9), 094302, 2013 | 98 | 2013 |
| On the directionality and non-linearity of halogen and hydrogen bonds JG Hill, AC Legon Physical Chemistry Chemical Physics 17 (2), 858-867, 2015 | 67 | 2015 |
| Calibration study of the CCSD (T)-F12a/b methods for C2 and small hydrocarbons D Feller, KA Peterson, JG Hill The Journal of chemical physics 133, 184102, 2010 | 66 | 2010 |
| Experimental electron density and neutron diffraction studies on the polymorphs of sulfathiazole I Sovago, MJ Gutmann, JG Hill, HM Senn, LH Thomas, CC Wilson, ... Crystal growth & design 14 (3), 1227-1239, 2014 | 56 | 2014 |
| Calculating stacking interactions in nucleic acid base-pair steps using spin-component scaling and local second order Møller–Plesset perturbation theory JG Hill, JA Platts Physical Chemistry Chemical Physics 10 (19), 2785-2791, 2008 | 50 | 2008 |
| Theoretical Insights into the Nature of Halogen Bonding in Prereactive Complexes JG Hill, X Hu Chemistry-A European Journal 19 (11), 3620-3628, 2013 | 49 | 2013 |
| Auxiliary basis sets for density fitting–MP2 calculations: Nonrelativistic triple-ζ all-electron correlation consistent basis sets for the 3d elements Sc–Zn JG Hill, JA Platts The Journal of chemical physics 128, 044104, 2008 | 49 | 2008 |
| Explicitly Correlated Coupled Cluster Calculations for Molecules Containing Group 11 (Cu, Ag, Au) and 12 (Zn, Cd, Hg) Elements: Optimized Complementary Auxiliary Basis Sets for … JG Hill, KA Peterson Journal of Chemical Theory and Computation 8 (2), 518-526, 2012 | 44 | 2012 |
| Auxiliary Basis Sets for Density Fitting in Explicitly Correlated Calculations: The Atoms H–Ar S Kritikou, JG Hill Journal of chemical theory and computation 11 (11), 5269-5276, 2015 | 42 | 2015 |
| Application of explicitly correlated coupled-cluster methods to molecules containing post-3 d main group elements KA Peterson, C Krause, H Stoll, JG Hill, HJ Werner Molecular Physics 109 (22), 2607-2623, 2011 | 40 | 2011 |
Kirk A PetersonProfessor of Chemistry, Washington State Universityایمیل تأیید شده در wsu.edu