| Linear-scaling atomic orbital-based second-order Møller–Plesset perturbation theory by rigorous integral screening criteria B Doser, DS Lambrecht, J Kussmann, C Ochsenfeld The Journal of chemical physics 130 (6), 2009 | 175 | 2009 |
| Rigorous integral screening for electron correlation methods DS Lambrecht, B Doser, C Ochsenfeld The Journal of chemical physics 123 (18), 2005 | 149 | 2005 |
| Optical spectra of oligothiophenes: vibronic states, torsional motions, and solvent shifts J Gierschner, HG Mack, HJ Egelhaaf, S Schweizer, B Doser, D Oelkrug Synthetic metals 138 (1-2), 311-315, 2003 | 99 | 2003 |
| Tighter multipole-based integral estimates and parallel implementation of linear-scaling AO–MP2 theory B Doser, DS Lambrecht, C Ochsenfeld Physical Chemistry Chemical Physics 10 (23), 3335-3344, 2008 | 92 | 2008 |
| An atomic orbital-based reformulation of energy gradients in second-order Møller–Plesset perturbation theory S Schweizer, B Doser, C Ochsenfeld The Journal of chemical physics 128 (15), 2008 | 80 | 2008 |
| Cholesky-decomposed densities in Laplace-based second-order Møller–Plesset perturbation theory J Zienau, L Clin, B Doser, C Ochsenfeld The Journal of chemical physics 130 (20), 2009 | 68 | 2009 |
| A workflow for exploring ligand dissociation from a macromolecule: Efficient random acceleration molecular dynamics simulation and interaction fingerprint analysis of ligand … DB Kokh, B Doser, S Richter, F Ormersbach, X Cheng, RC Wade The Journal of chemical physics 153 (12), 2020 | 58 | 2020 |
| Linear‐scaling Cholesky decomposition S Schweizer, J Kussmann, B Doser, C Ochsenfeld Journal of computational chemistry 29 (6), 1004-1010, 2008 | 50 | 2008 |
| A linear-scaling MP2 method for large molecules by rigorous integral-screening criteria B Doser, J Zienau, L Clin, DS Lambrecht, C Ochsenfeld Zeitschrift für Physikalische Chemie 224 (3-4), 397-412, 2010 | 49 | 2010 |
| ASP Conf. Ser. Vol. 495, Astronomical Data Analysis Software and Systems XXIV (ADASS XXIV) T Martin, L Drissen, G Joncas, AR Taylor, E Rosolowsky Astron. Soc. Pac, San Francisco, 2015 | 38 | 2015 |
| Pink: Parallelized rotation and flipping invariant kohonen maps KL Polsterer, F Gieseke, B Doser Astrophysics Source Code Library, ascl: 1910.001, 2019 | 6 | 2019 |
| Wasserstoffbrückenbindungen mit Cyanidionen? Die Strukturen von 1, 3‐Diisopropyl‐4, 5‐dimethylimidazoliumcyanid und 1‐Isopropyl‐3, 4, 5‐trimethylimidazoliumcyanid N Kuhn, K Eichele, M Steimann, A Al‐Sheikh, B Doser, C Ochsenfeld Zeitschrift für anorganische und allgemeine Chemie 632 (14), 2268-2275, 2006 | 6 | 2006 |
| Unexpected dimerization of 1, 3‐dimethyl‐5‐methylenebarbituric acid revealed by a combined experimental and computational study B Doser, K Sweidan, N Kuhn, C Ochsenfeld Journal of Physical Organic Chemistry 28 (5), 354-357, 2015 | 4 | 2015 |
| Erratum:“Rigorous integral screening for electron correlation methods”[J. Chem. Phys. 123, 184102 (2005)] DS Lambrecht, B Doser, C Ochsenfeld The Journal of chemical physics 136 (14), 2012 | 3 | 2012 |
| Parallelized rotation and flipping INvariant Kohonen maps (PINK) on GPUs KL Polsterer, FC Gieseke, C Igel, B Doser, N Gianniotis Bruges: i6doc. com, 2016 | 2 | 2016 |
| Hydrogen bonds with cyanide ions? The structures of 1, 3-diisopropyl-4, 5-dimethylimidazolium cyanide and 1-isopropyl-3, 4, 5-trimethylimidazolium cyanide N Kuhn, K Eichele, M Steimann, A Al-Sheikh, B Doser, C Ochsenfeld Z. Anorg. Allg. Chem 632, 2268-2275, 2006 | 2 | 2006 |
| Linear skalierende Møller-Plesset-Störungstheorie zur Berechnung der Elektronenkorrelation in großen Molekülen B Doser Universität Tübingen, 2009 | 1 | 2009 |
| A workflow for exploring ligand dissociation from a macromolecule DB Kokh, B Doser, S Richter, F Ormersbach, X Cheng, RC Wade | | 2020 |
| Tutorial: Running τRAMD using Gromacs v. 1.0 DB Kokh, B Doser, X Cheng, S Richter, RC Wade | | 2020 |
| First-year experience with fully automated crystal structure prediction M Neumann, B Doser Foundations of Crystallography A 70, C1618, 2014 | | 2014 |
Christian OchsenfeldChair of Theoretical Chemistry, University of Munich (LMU)Vahvistettu sähköpostiosoite verkkotunnuksessa cup.uni-muenchen.de
