Theory and application of explicitly correlated Gaussians J Mitroy, S Bubin, W Horiuchi, Y Suzuki, L Adamowicz, W Cencek, ... Reviews of modern physics 85 (2), 693-749, 2013 | 362 | 2013 |
Effects of adiabatic, relativistic, and quantum electrodynamics interactions on the pair potential and thermophysical properties of helium W Cencek, M Przybytek, J Komasa, JB Mehl, B Jeziorski, K Szalewicz The Journal of Chemical Physics 136 (22), 2012 | 311 | 2012 |
SAPT2008: An ab initio program for many-body symmetry-adapted perturbation theory calculations of intermolecular interaction energies R Bukowski, W Cencek, P Jankowski, M Jeziorska, B Jeziorski, ... University of Delaware and University of Warsaw, 2008 | 241 | 2008 |
Sub-microhartree accuracy potential energy surface for including adiabatic and relativistic effects. I. Calculation of the potential points W Cencek, J Rychlewski, R Jaquet, W Kutzelnigg The Journal of Chemical Physics 108 (7), 2831-2836, 1998 | 218 | 1998 |
Interaction energies of large clusters from many-body expansion U Góra, R Podeszwa, W Cencek, K Szalewicz The Journal of chemical physics 135 (22), 2011 | 180 | 2011 |
Relativistic and quantum electrodynamics effects in the helium pair potential M Przybytek, W Cencek, J Komasa, G Łach, B Jeziorski, K Szalewicz Physical review letters 104 (18), 183003, 2010 | 178 | 2010 |
Pair potential for helium from symmetry-adapted perturbation theory calculations and from supermolecular data M Jeziorska, W Cencek, K Patkowski, B Jeziorski, K Szalewicz The Journal of chemical physics 127 (12), 2007 | 176 | 2007 |
Potential energy surface for interactions between two hydrogen molecules K Patkowski, W Cencek, P Jankowski, K Szalewicz, JB Mehl, ... The Journal of chemical physics 129 (9), 2008 | 168 | 2008 |
Many‐electron explicitly correlated Gaussian functions. I. General theory and test results W Cencek, J Rychlewski The Journal of chemical physics 98 (2), 1252-1261, 1993 | 158 | 1993 |
Explicitly correlated Gaussian functions in variational calculations: The ground state of the beryllium atom J Komasa, W Cencek, J Rychlewski Physical Review A 52 (6), 4500, 1995 | 138 | 1995 |
Benchmark calculations for two-electron systems using explicitly correlated Gaussian functions W Cencek, J Komasa, J Rychlewski Chemical physics letters 246 (4-5), 417-420, 1995 | 129 | 1995 |
Sub-microhartree accuracy potential energy surface for including adiabatic and relativistic effects. II. Rovibrational analysis for and R Jaquet, W Cencek, W Kutzelnigg, J Rychlewski The Journal of Chemical Physics 108 (7), 2837-2846, 1998 | 124 | 1998 |
An accurate analytic representation of the water pair potential W Cencek, K Szalewicz, C Leforestier, R van Harrevelt, A van der Avoird Physical Chemistry Chemical Physics 10 (32), 4716-4731, 2008 | 115 | 2008 |
Many‐electron explicitly correlated Gaussian functions. II. Ground state of the helium molecular ion He+2 W Cencek, J Rychlewski The Journal of chemical physics 102 (6), 2533-2538, 1995 | 114 | 1995 |
The equivalence of explicitly correlated slater and Gaussian functions in variational quantum chemistry computations: the ground state of H2 J Rychlewski, W Cencek, J Komasa Chemical Physics Letters 229 (6), 657-660, 1994 | 102 | 1994 |
Accurate relativistic energies of one‐and two‐electron systems using Gaussian wave functions W Cencek, W Kutzelnigg The Journal of chemical physics 105 (14), 5878-5885, 1996 | 96 | 1996 |
Accurate adiabatic correction for the hydrogen molecule using the Born-Handy formula W Cencek, W Kutzelnigg Chemical physics letters 266 (3-4), 383-387, 1997 | 85 | 1997 |
Benchmark calculations for He2+ and LiH molecules using explicitly correlated Gaussian functions W Cencek, J Rychlewski Chemical Physics Letters 320 (5-6), 549-552, 2000 | 84 | 2000 |
Predictions for water clusters from a first-principles two-and three-body force field U Góra, W Cencek, R Podeszwa, A van der Avoird, K Szalewicz The Journal of Chemical Physics 140 (19), 2014 | 81 | 2014 |
Ultra‐high accuracy calculations for hydrogen molecule and helium dimer W Cencek, K Szalewicz International Journal of Quantum Chemistry 108 (12), 2191-2198, 2008 | 77 | 2008 |