The equation of motion coupled‐cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties JF Stanton, RJ Bartlett
The Journal of chemical physics 98 (9), 7029-7039, 1993
2821 1993 HEAT: High accuracy extrapolated ab initio thermochemistry A Tajti, PG Szalay, AG Császár, M Kállay, J Gauss, EF Valeev, ...
The Journal of chemical physics 121 (23), 11599-11613, 2004
905 2004 Applications of Post‐Hartree—Fock Methods: A Tutorial RJ Bartlett, JF Stanton
Reviews in computational chemistry, 65-169, 1994
721 1994 The ACES II program system JF Stanton, J Gauss, JD Watts, WJ Lauderdale, RJ Bartlett
International Journal of Quantum Chemistry 44 (S26), 879-894, 1992
698 1992 Analytic energy derivatives for ionized states described by the equation‐of‐motion coupled cluster method JF Stanton, J Gauss
The Journal of chemical physics 101 (10), 8938-8944, 1994
675 1994 Coupled-cluster techniques for computational chemistry: The CFOUR program package DA Matthews, L Cheng, ME Harding, F Lipparini, S Stopkowicz, TC Jagau, ...
The Journal of Chemical Physics 152 (21), 2020
561 2020 Why CCSD (T) works: a different perspective JF Stanton
Chemical Physics Letters 281 (1-3), 130-134, 1997
544 1997 High-accuracy extrapolated ab initio thermochemistry. III. Additional improvements and overview ME Harding, J Vázquez, B Ruscic, AK Wilson, J Gauss, JF Stanton
The Journal of chemical physics 128 (11), 2008
481 2008 Coupled-cluster methods including noniterative corrections for quadruple excitations YJ Bomble, JF Stanton, M Kállay, J Gauss
The Journal of chemical physics 123 (5), 2005
459 2005 Perturbative treatment of triple excitations in coupled‐cluster calculations of nuclear magnetic shielding constants J Gauss, JF Stanton
The Journal of chemical physics 104 (7), 2574-2583, 1996
441 1996 Analytic CCSD (T) second derivatives J Gauss, JF Stanton
Chemical physics letters 276 (1-2), 70-77, 1997
432 1997 The accurate determination of molecular equilibrium structures KL Bak, J Gauss, P Jørgensen, J Olsen, T Helgaker, JF Stanton
The Journal of Chemical Physics 114 (15), 6548-6556, 2001
412 2001 High-accuracy extrapolated ab initio thermochemistry. II. Minor improvements to the protocol and a vital simplification YJ Bomble, J Vázquez, M Kállay, C Michauk, PG Szalay, AG Császár, ...
The Journal of chemical physics 125 (6), 2006
405 2006 IUPAC critical evaluation of thermochemical properties of selected radicals. Part I B Ruscic, JE Boggs, A Burcat, AG Császár, J Demaison, R Janoschek, ...
Journal of physical and chemical reference data 34 (2), 573-656, 2005
350 2005 Quantum-chemical calculation of spectroscopic parameters for rotational spectroscopy C Puzzarini, JF Stanton, J Gauss
International Reviews in Physical Chemistry 29 (2), 273-367, 2010
348 2010 Coupled‐cluster calculations of nuclear magnetic resonance chemical shifts J Gauss, JF Stanton
The Journal of chemical physics 103 (9), 3561-3577, 1995
331 1995 Coupled‐cluster open‐shell analytic gradients: Implementation of the direct product decomposition approach in energy gradient calculations J Gauss, JF Stanton, RJ Bartlett
The Journal of chemical physics 95 (4), 2623-2638, 1991
327 1991 A direct product decomposition approach for symmetry exploitation in many‐body methods. I. Energy calculations JF Stanton, J Gauss, JD Watts, RJ Bartlett
The Journal of Chemical Physics 94 (6), 4334-4345, 1991
323 1991 Analytic second derivatives in high-order many-body perturbation and coupled-cluster theories: Computational considerations and applications JF Stanton, J Gauss
International Reviews in Physical Chemistry 19 (1), 61-95, 2000
290 2000 Quantitative prediction of gas-phase AA Auer, J Gauss, JF Stanton
The Journal of chemical physics 118 (23), 10407-10417, 2003
289 2003 