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The Journal of Chemical Physics|June 16, 2014
Cholesky-decomposed density MP2 with density fitting: accurate MP2 and double-hybrid DFT energies for large systemsSimon A Maurer, Lucien Clin, Christian Ochsenfeld
Journal of Chemical Theory and Computation|December 30, 2020
Low-Scaling Tensor Hypercontraction in the Cholesky Molecular Orbital Basis Applied to Second-Order Møller-Plesset Perturbation TheoryFelix H Bangerter, Michael Glasbrenner, Christian Ochsenfeld
Journal of Chemical Theory and Computation|March 7, 2017
Vanishing-Overhead Linear-Scaling Random Phase Approximation by Cholesky Decomposition and an Attenuated Coulomb-MetricArne Luenser, Henry F Schurkus, Christian Ochsenfeld
Journal of Chemical Theory and Computation|August 9, 2022
Tensor-Hypercontracted MP2 First Derivatives: Runtime and Memory Efficient Computation of Hyperfine Coupling ConstantsFelix H Bangerter, Michael Glasbrenner, Christian Ochsenfeld
Journal of Chemical Theory and Computation|October 20, 2023
Analytical Second-Order Properties for the Random Phase Approximation: Nuclear Magnetic Resonance ShieldingsViktoria Drontschenko, Felix H Bangerter, Christian Ochsenfeld
Journal of the American Chemical Society|March 27, 2018
Base-Independent DNA Base-Excision Repair of 8-OxoguanineAndrea Kreppel, Iris D Blank, Christian Ochsenfeld
Journal of Chemical Theory and Computation|September 15, 2016
A Dynamic Equilibrium of Three Hydrogen-Bond Conformers Explains the NMR Spectrum of the Active Site of Photoactive Yellow ProteinPhillip Johannes Taenzler, Keyarash Sadeghian, Christian Ochsenfeld
The Journal of Chemical Physics|November 19, 2005
Rigorous integral screening for electron correlation methodsDaniel S Lambrecht, Bernd Doser, Christian Ochsenfeld
Physical Chemistry Chemical Physics : PCCP|June 7, 2008
Tighter multipole-based integral estimates and parallel implementation of linear-scaling AO-MP2 theoryBernd Doser, Daniel S Lambrecht, Christian Ochsenfeld
Journal of Chemical Theory and Computation|June 18, 2025
Combining Fast Exploration with Accurate Reweighting in the OPES-eABF Hybrid Sampling MethodAndreas Hulm, Robert P Schiller, Christian Ochsenfeld
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