These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
319 related articles for article (PubMed ID: 20614953)
1. Density fitting of intramonomer correlation effects in symmetry-adapted perturbation theory. Hohenstein EG; Sherrill CD J Chem Phys; 2010 Jul; 133(1):014101. PubMed ID: 20614953 [TBL] [Abstract][Full Text] [Related]
2. Accurate description of intermolecular interactions involving ions using symmetry-adapted perturbation theory. Lao KU; Schäffer R; Jansen G; Herbert JM J Chem Theory Comput; 2015 Jun; 11(6):2473-86. PubMed ID: 26575547 [TBL] [Abstract][Full Text] [Related]
3. Density-functional theory-symmetry-adapted intermolecular perturbation theory with density fitting: a new efficient method to study intermolecular interaction energies. Hesselmann A; Jansen G; Schütz M J Chem Phys; 2005 Jan; 122(1):14103. PubMed ID: 15638638 [TBL] [Abstract][Full Text] [Related]
5. Levels of symmetry adapted perturbation theory (SAPT). I. Efficiency and performance for interaction energies. Parker TM; Burns LA; Parrish RM; Ryno AG; Sherrill CD J Chem Phys; 2014 Mar; 140(9):094106. PubMed ID: 24606352 [TBL] [Abstract][Full Text] [Related]
6. Efficient evaluation of triple excitations in symmetry-adapted perturbation theory via second-order Møller-Plesset perturbation theory natural orbitals. Hohenstein EG; Sherrill CD J Chem Phys; 2010 Sep; 133(10):104107. PubMed ID: 20849164 [TBL] [Abstract][Full Text] [Related]
7. Highly accurate CCSD(T) and DFT-SAPT stabilization energies of H-bonded and stacked structures of the uracil dimer. Pitonák M; Riley KE; Neogrády P; Hobza P Chemphyschem; 2008 Aug; 9(11):1636-44. PubMed ID: 18574830 [TBL] [Abstract][Full Text] [Related]
8. Symmetry-adapted perturbation-theory calculations of intermolecular forces employing density-functional description of monomers. Misquitta AJ; Szalewicz K J Chem Phys; 2005 Jun; 122(21):214109. PubMed ID: 15974730 [TBL] [Abstract][Full Text] [Related]
9. Extrapolation and Scaling of the DFT-SAPT Interaction Energies toward the Basis Set Limit. Řezáč J; Hobza P J Chem Theory Comput; 2011 Mar; 7(3):685-9. PubMed ID: 26596299 [TBL] [Abstract][Full Text] [Related]
10. How accurate is the density functional theory combined with symmetry-adapted perturbation theory approach for CH-pi and pi-pi interactions? A comparison to supermolecular calculations for the acetylene-benzene dimer. Tekin A; Jansen G Phys Chem Chem Phys; 2007 Apr; 9(14):1680-7. PubMed ID: 17396179 [TBL] [Abstract][Full Text] [Related]
11. Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions. Toulouse J; Zhu W; Savin A; Jansen G; Ángyán JG J Chem Phys; 2011 Aug; 135(8):084119. PubMed ID: 21895171 [TBL] [Abstract][Full Text] [Related]
12. Comparison of intermolecular interaction energies from SAPT and DFT including empirical dispersion contributions. Hesselmann A J Phys Chem A; 2011 Oct; 115(41):11321-30. PubMed ID: 21806071 [TBL] [Abstract][Full Text] [Related]
13. Accurate Prediction of Noncovalent Interaction Energies with the Effective Fragment Potential Method: Comparison of Energy Components to Symmetry-Adapted Perturbation Theory for the S22 Test Set. Flick JC; Kosenkov D; Hohenstein EG; Sherrill CD; Slipchenko LV J Chem Theory Comput; 2012 Aug; 8(8):2835-43. PubMed ID: 26592124 [TBL] [Abstract][Full Text] [Related]
14. Frozen core and effective core potentials in symmetry-adapted perturbation theory. Patkowski K; Szalewicz K J Chem Phys; 2007 Oct; 127(16):164103. PubMed ID: 17979315 [TBL] [Abstract][Full Text] [Related]
15. Intermolecular potentials based on symmetry-adapted perturbation theory with dispersion energies from time-dependent density-functional calculations. Misquitta AJ; Podeszwa R; Jeziorski B; Szalewicz K J Chem Phys; 2005 Dec; 123(21):214103. PubMed ID: 16356035 [TBL] [Abstract][Full Text] [Related]
16. Theoretical thermodynamics for large molecules: walking the thin line between accuracy and computational cost. Schwabe T; Grimme S Acc Chem Res; 2008 Apr; 41(4):569-79. PubMed ID: 18324790 [TBL] [Abstract][Full Text] [Related]
17. Three-body symmetry-adapted perturbation theory based on Kohn-Sham description of the monomers. Podeszwa R; Szalewicz K J Chem Phys; 2007 May; 126(19):194101. PubMed ID: 17523792 [TBL] [Abstract][Full Text] [Related]