Communication: An effective linear-scaling atomic-orbital reformulation of the random-phase approximation using a contracted double-Laplace transformation

Sublinear scaling for time-dependent stochastic density functional theory

(2015) Yi Gao et al.   JOURNAL OF CHEMICAL PHYSICS

Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights

(2015) Bastien Mussard et al.   JOURNAL OF CHEMICAL PHYSICS

Linear-scaling implementation of the direct random-phase approximation

(2015) Mihály Kállay   JOURNAL OF CHEMICAL PHYSICS

Accurate Complete Basis Set Extrapolation of Direct Random Phase Correlation Energies

(2015) Pál D. Mezei et al.   Journal of Chemical Theory and Computation

Preselective Screening for Linear-Scaling Exact Exchange-Gradient Calculations for Graphics Processing Units and General Strong-Scaling Massively Parallel Calculations

(2015) Jörg Kussmann et al.   Journal of Chemical Theory and Computation

Tensor hypercontracted ppRPA: Reducing the cost of the particle-particle random phase approximation from O(r 6) to O(r 4)

(2014) Neil Shenvi et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: A reduced scaling J-engine based reformulation of SOS-MP2 using graphics processing units

(2014) S. A. Maurer et al.   JOURNAL OF CHEMICAL PHYSICS

Cholesky-decomposed density MP2 with density fitting: Accurate MP2 and double-hybrid DFT energies for large systems

(2014) Simon A. Maurer et al.   JOURNAL OF CHEMICAL PHYSICS

Low Scaling Algorithms for the Random Phase Approximation: Imaginary Time and Laplace Transformations

(2014) Merzuk Kaltak et al.   Journal of Chemical Theory and Computation

Efficient distance-including integral screening in linear-scaling Møller-Plesset perturbation theory

(2013) Simon A. Maurer et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Analytic gradients in the random-phase approximation

(2013) Johannes Rekkedal et al.   JOURNAL OF CHEMICAL PHYSICS

Pre-selective screening for matrix elements in linear-scaling exact exchange calculations

(2013) Jörg Kussmann et al.   JOURNAL OF CHEMICAL PHYSICS

Analytical First-Order Molecular Properties and Forces within the Adiabatic Connection Random Phase Approximation

(2013) Asbjörn M. Burow et al.   Journal of Chemical Theory and Computation

Linear-scaling self-consistent field methods for large molecules

(2013) Jörg Kussmann et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Basis set convergence of molecular correlation energy differences within the random phase approximation

(2012) Henk Eshuis et al.   JOURNAL OF CHEMICAL PHYSICS

Random-phase approximation and its applications in computational chemistry and materials science

(2012) Xinguo Ren et al.   JOURNAL OF MATERIALS SCIENCE

Assessment of correlation energies based on the random-phase approximation

(2012) Joachim Paier et al.   NEW JOURNAL OF PHYSICS

Electron correlation methods based on the random phase approximation

(2012) Henk Eshuis et al.   THEORETICAL CHEMISTRY ACCOUNTS

A Parameter-Free Density Functional That Works for Noncovalent Interactions

(2011) Henk Eshuis et al.   Journal of Physical Chemistry Letters

Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration

(2010) Henk Eshuis et al.   JOURNAL OF CHEMICAL PHYSICS

Cholesky-decomposed densities in Laplace-based second-order Møller–Plesset perturbation theory

(2009) Jan Zienau et al.   JOURNAL OF CHEMICAL PHYSICS

Linear-scaling atomic orbital-based second-order Møller–Plesset perturbation theory by rigorous integral screening criteria

(2009) Bernd Doser et al.   JOURNAL OF CHEMICAL PHYSICS

A General Database for Main Group Thermochemistry, Kinetics, and Noncovalent Interactions − Assessment of Common and Reparameterized (meta-)GGA Density Functionals

(2009) Lars Goerigk et al.   Journal of Chemical Theory and Computation

Minimax approximation for the decomposition of energy denominators in Laplace-transformed Møller–Plesset perturbation theories

(2008) Akio Takatsuka et al.   JOURNAL OF CHEMICAL PHYSICS

An atomic orbital-based reformulation of energy gradients in second-order Møller–Plesset perturbation theory

(2008) Sabine Schweizer et al.   JOURNAL OF CHEMICAL PHYSICS

Developing the random phase approximation into a practical post-Kohn–Sham correlation model

(2008) Filipp Furche   JOURNAL OF CHEMICAL PHYSICS

Computing $A^\alpha, \log(A)$, and Related Matrix Functions by Contour Integrals

(2008) Nicholas Hale et al.   SIAM JOURNAL ON NUMERICAL ANALYSIS