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Publications by authors named "Kathrin Helen Hopmann"

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Scalar Relativistic Effects with Multiwavelets: Implementation and Benchmark.
Anders Brakestad, Stig Rune Jensen, Christian Tantardini, Quentin Pitteloud, Peter Wind, Kathrin Helen Hopmann

J Chem Theory Comput· January 2024


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Multiwavelets applied to metal-ligand interactions: Energies free from basis set errors.
Anders Brakestad, Peter Wind, Stig Rune Jensen, Luca Frediani, Kathrin Helen Hopmann

J Chem Phys· June 2021


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Static Polarizabilities at the Basis Set Limit: A Benchmark of 124 Species.
Anders Brakestad, Stig Rune Jensen, Peter Wind, Marco D'Alessandro, Luigi Genovese, Kathrin Helen Hopmann

J Chem Theory Comput· August 2020


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Computer Simulations Reveal Substrate Specificity of Glycosidic Bond Cleavage in Native and Mutant Human Purine Nucleoside Phosphorylase.
Geir Villy Isaksen, Kathrin Helen Hopmann, Johan Åqvist, Bjørn Olav Brandsdal

Biochemistry· April 2016


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