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The Journal of Chemical Physics|May 10, 2013
A linear- and sublinear-scaling method for calculating NMR shieldings in atomic orbital-based second-order Møller-Plesset perturbation theoryMarina Maurer, Christian OchsenfeldThe Journal of Chemical Physics|January 3, 2019
Low-scaling analytical gradients for the direct random phase approximation using an atomic orbital formalismMatthias Beuerle, 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|January 24, 2016
Communication: An effective linear-scaling atomic-orbital reformulation of the random-phase approximation using a contracted double-Laplace transformationHenry F Schurkus, Christian OchsenfeldThe Journal of Chemical Physics|February 3, 2019
Integral partition bounds for fast and effective screening of general one-, two-, and many-electron integralsTravis H Thompson, Christian OchsenfeldThe Journal of Physical Chemistry. A|July 10, 2009
A convergence study of QM/MM isomerization energies with the selected size of the QM region for peptidic systemsChris Vanessa Sumowski, Christian OchsenfeldThe Journal of Chemical Physics|October 17, 2017
Distance-including rigorous upper bounds and tight estimates for two-electron integrals over long- and short-range operatorsTravis H Thompson, Christian OchsenfeldThe Journal of Chemical Physics|November 19, 2005
Multipole-based integral estimates for the rigorous description of distance dependence in two-electron integralsDaniel S Lambrecht, 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 OchsenfeldPageof 27