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The Journal of Chemical Physics|April 12, 2013
Pre-selective screening for matrix elements in linear-scaling exact exchange calculationsJörg Kussmann, Christian OchsenfeldThe Journal of Chemical Physics|April 10, 2008
Linear-scaling fixed-node diffusion quantum Monte Carlo: accounting for the nodal information in a density matrix-based schemeJörg Kussmann, Christian OchsenfeldJournal of Chemical Theory and Computation|November 19, 2015
Preselective Screening for Linear-Scaling Exact Exchange-Gradient Calculations for Graphics Processing Units and General Strong-Scaling Massively Parallel CalculationsJörg Kussmann, Christian OchsenfeldThe Journal of Chemical Physics|December 7, 2007
A density matrix-based method for the linear-scaling calculation of dynamic second- and third-order properties at the Hartree-Fock and Kohn-Sham density functional theory levelsJörg Kussmann, Christian OchsenfeldJournal of Chemical Theory and Computation|June 22, 2017
Hybrid CPU/GPU Integral Engine for Strong-Scaling Ab Initio MethodsJörg Kussmann, Christian OchsenfeldJournal of Chemical Theory and Computation|June 1, 2017
Employing OpenCL to Accelerate Ab Initio Calculations on Graphics Processing UnitsJörg Kussmann, Christian OchsenfeldThe Journal of Chemical Physics|August 11, 2007
Linear-scaling method for calculating nuclear magnetic resonance chemical shifts using gauge-including atomic orbitals within Hartree-Fock and density-functional theoryJörg Kussmann, Christian OchsenfeldThe Journal of Chemical Physics|July 9, 2021
Accelerating seminumerical Fock-exchange calculations using mixed single- and double-precision arithmethicHenryk Laqua, Jörg Kussmann, Christian OchsenfeldThe Journal of Chemical Physics|April 17, 2017
Screening methods for linear-scaling short-range hybrid calculations on CPU and GPU architecturesMatthias Beuerle, Jörg Kussmann, Christian OchsenfeldCommunications Chemistry|April 22, 2026
A detailed comparison of ΔSCF methods with the constraint-based orbital-optimized excited state methodYannick Lemke, Jörg Kussmann, Christian OchsenfeldPageof 17