Fabijan Pavošević

Massively Parallel Quantum Chemistry: A high-performance research platform for electronic structure.

Ashutosh Kumar, Jinmei Zhang, Chong Peng, 2020, The Journal of chemical physics.

Geminal-spanning orbitals make explicitly correlated reduced-scaling coupled-cluster methods robust, yet simple.

Frank Neese, Edward F. Valeev, Edward F Valeev, 2014, The Journal of chemical physics.

SparseMaps-A systematic infrastructure for reduced scaling electronic structure methods. V. Linear scaling explicitly correlated coupled-cluster method with pair natural orbitals.

Frank Neese, Edward F. Valeev, Christoph Riplinger, 2017, The Journal of chemical physics.

Massively Parallel Implementation of Explicitly Correlated Coupled-Cluster Singles and Doubles Using TiledArray Framework.

Justus A. Calvin, Edward F. Valeev, Edward F Valeev, 2016, The journal of physical chemistry. A.

SparseMaps--A systematic infrastructure for reduced-scaling electronic structure methods. IV. Linear-scaling second-order explicitly correlated energy with pair natural orbitals.

Frank Neese, Edward F. Valeev, Edward F Valeev, 2016, The Journal of chemical physics.