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Golze, Dorothea; Wilhelm, Jan; van Setten, Michiel J; Rinke, Patrick (2018). Core-Level Binding Energies from GW: An Efficient Full-Frequency Approach within a Localized Basis. Journal of Chemical Theory and Computation, 14(9):4856-4869.

Wilhelm, Jan; Golze, Dorothea; Talirz, Leopold; Hutter, Jürg; Pignedoli, Carlo A (2018). Toward GW Calculations on Thousands of Atoms. Journal of Physical Chemistry Letters, 9(2):306-312.

Golze, Dorothea; Benedikter, Niels; Iannuzzi, Marcella; Wilhelm, Jan; Hutter, Jürg (2017). Fast evaluation of solid harmonic Gaussian integrals for local resolution-of-the-identity methods and range-separated hybrid functionals. Journal of Chemical Physics, 146(3):034105.

Golze, Dorothea; Iannuzzi, Marcella; Hutter, Jürg (2017). Local Fitting of the Kohn–Sham Density in a Gaussian and Plane Waves Scheme for Large-Scale Density Functional Theory Simulations. Journal of Chemical Theory and Computation, 13(5):2202-2214.

Golze, Dorothea. Efficient Methods to reduce the Complexity of the Charge Density within Density Functional Theory for large Systems. 2015, University of Zurich, Faculty of Science.

Golze, Dorothea; Hutter, Jürg; Iannuzzi, Marcella (2015). Wetting of water on hexagonal boron nitride@Rh(111): a QM/MM model based on atomic charges derived for nano-structured substrates. Physical Chemistry Chemical Physics (PCCP), 17(22):14307-14316.

Golze, Dorothea; Iannuzzi, Marcella; Nguyen, Manh-Thuong; Passerone, Daniele; Hutter, Juerg (2013). Simulation of Adsorption Processes at Metallic Interfaces: An Image Charge Augmented QM/MM Approach. Journal of Chemical Theory and Computation, 9(11):5086-5097.

This list was generated on Fri Jul 19 12:47:29 2019 CEST.