Single-determinant-based symmetry-adapted perturbation theory without single-exchange approximation

Symmetry-adapted perturbation theory based on density functional theory for noncovalent interactions

(2013) Georg Jansen   Wiley Interdisciplinary Reviews-Computational Molecular Science

Breakdown of the Single-Exchange Approximation in Third-Order Symmetry-Adapted Perturbation Theory

(2012) Ka Un Lao et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Intermolecular exchange-induction energies without overlap expansion

(2012) Rainer Schäffer et al.   THEORETICAL CHEMISTRY ACCOUNTS

Symmetry-adapted perturbation theory of intermolecular forces

(2011) Krzysztof Szalewicz   Wiley Interdisciplinary Reviews-Computational Molecular Science

Orbital relaxation and the third-order induction energy in symmetry-adapted perturbation theory

(2010) Konrad Patkowski et al.   THEORETICAL CHEMISTRY ACCOUNTS

Optimized complementary auxiliary basis sets for explicitly correlated methods: aug-cc-pVnZ orbital basis sets

(2009) Kazim E. Yousaf et al.   CHEMICAL PHYSICS LETTERS

Simplified CCSD(T)-F12 methods: Theory and benchmarks

(2009) Gerald Knizia et al.   JOURNAL OF CHEMICAL PHYSICS

Accurate Calculations of Intermolecular Interaction Energies Using Explicitly Correlated Coupled Cluster Wave Functions and a Dispersion-Weighted MP2 Method†

(2009) Oliver Marchetti et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ab initio intermolecular potential energy surfaces of the water-rare gas atom complexes

(2008) Jan Makarewicz   JOURNAL OF CHEMICAL PHYSICS