An efficient linear scaling procedure for constructing localized orbitals of large molecules based on the one-particle density matrix

Local orbitals by minimizing powers of the orbital variance

(2011) Branislav Jansík et al.   JOURNAL OF CHEMICAL PHYSICS

Fast Sparse Cholesky Decomposition and Inversion using Nested Dissection Matrix Reordering

(2011) Kai Brandhorst et al.   Journal of Chemical Theory and Computation

Bringing about matrix sparsity in linear-scaling electronic structure calculations

(2011) Emanuel H. Rubensson et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Kohn−Sham Density Functional Theory Electronic Structure Calculations with Linearly Scaling Computational Time and Memory Usage

(2010) Elias Rudberg et al.   Journal of Chemical Theory and Computation

Local correlation calculations using standard and renormalized coupled-cluster approaches

(2009) Wei Li et al.   JOURNAL OF CHEMICAL PHYSICS

Linear-scaling Cholesky decomposition

(2007) Sabine Schweizer et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY