| The Dalton quantum chemistry program system K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014 | 1492 | 2014 |
| Cooperativity in Hydrogen-Bonded Interactions: Ab Initio and “Atoms in Molecules” Analyses M Ziólkowski, SJ Grabowski, J Leszczynski The Journal of Physical Chemistry A 110 (20), 6514-6521, 2006 | 388 | 2006 |
| Linear scaling coupled cluster method with correlation energy based error control M Ziółkowski, B Jansík, T Kjærgaard, P Jørgensen The Journal of chemical physics 133 (1), 2010 | 174 | 2010 |
| A Locality analysis of the divide-expand-consolidate (DEC) coupled cluster amplitude equations K Kristensen, M Ziolkowski, B Jansik, T Kjaergaard, P Jorgensen Journal of Chemical Theory and Computation, 0 | 106 | |
| Artificial intelligence and deep learning applications for automotive manufacturing A Luckow, K Kennedy, M Ziolkowski, E Djerekarov, M Cook, E Duffy, ... 2018 IEEE International Conference on Big Data (Big Data), 3144-3152, 2018 | 74 | 2018 |
| Maximum locality in occupied and virtual orbital spaces using a least-change strategy M Ziółkowski, B Jansík, P Jørgensen, J Olsen The Journal of chemical physics 131 (12), 2009 | 46 | 2009 |
| Linear and nonlinear optical properties of azobenzene derivatives P Krawczyk, A Kaczmarek, R Zaleśny, K Matczyszyn, W Bartkowiak, ... Journal of molecular modeling 15 (6), 581-590, 2009 | 31 | 2009 |
| The nature of interactions in uracil dimer: An ab initio study Z Czyznikowska, R Zalesny, M Ziolkowski, RW Gora, P Cysewski Chemical Physics Letters 450 (1-3), 132-137, 2007 | 30 | 2007 |
| An efficient algorithm for solving nonlinear equations with a minimal number of trial vectors: Applications to atomic-orbital based coupled-cluster theory M Ziolkowski, V Weijo, P Jo-rgensen, J Olsen Journal of Chemical Physics 128 (20), 204105-204105, 2008 | 28 | 2008 |
| Two-photon and time-resolved fluorescence spectroscopy as probes for structural determination in amyloid-β peptides and aggregates TB Clark, M Ziółkowski, GC Schatz, T Goodson III The Journal of Physical Chemistry B 118 (9), 2351-2359, 2014 | 26 | 2014 |
| Modeling the electron-impact dissociation of methane M Ziółkowski, A Vikár, ML Mayes, Á Bencsura, G Lendvay, GC Schatz The Journal of chemical physics 137 (22), 2012 | 25 | 2012 |
| Fitting the derivative surfaces for full-dimensional interaction potentials P Jankowski, M Ziółkowski Molecular Physics 104 (13-14), 2293-2302, 2006 | 14* | 2006 |
| Performance and memory trade-offs of deep learning object detection in fast streaming high-definition images A Srivastava, D Nguyen, S Aggarwal, A Luckow, E Duffy, K Kennedy, ... 2018 IEEE International Conference on Big Data (Big Data), 3915-3924, 2018 | 13 | 2018 |
| Synthetic image data for deep learning JW Anderson, M Ziolkowski, K Kennedy, AW Apon arXiv preprint arXiv:2212.06232, 2022 | 10 | 2022 |
| Unifying computing resources and access interface to support parallel and distributed computing education LB Ngo, AT Srinath, J Denton, M Ziolkowski Journal of Parallel and Distributed Computing 118, 201-212, 2018 | 9 | 2018 |
| O2(X3Σg−) and O2(a1Δg) charge exchange with simple ions M Ziółkowski, GC Schatz, AA Viggiano, A Midey, I Dotan The Journal of Chemical Physics 140 (21), 2014 | 7* | 2014 |
| Deployment of a cloud pipeline for real‐time visual inspection using fast streaming high‐definition images A Srivastava, S Aggarwal, A Apon, E Duffy, K Kennedy, A Luckow, ... Software: Practice and Experience 50 (6), 868-898, 2020 | 4 | 2020 |
| Predicting the infrared transition intensities in the Ar-HF complex: The key role of the dipole moment surface accuracy P Jankowski, M Ziolkowski Journal of Chemical Physics 128 (3), 34308-34308, 2008 | 4 | 2008 |
| BMW Agents--A Framework For Task Automation Through Multi-Agent Collaboration N Crawford, EB Duffy, I Evazzade, T Foehr, G Robbins, DK Saha, J Varma, ... arXiv preprint arXiv:2406.20041, 2024 | 3 | 2024 |
| Quantum inspired optimization for industrial scale problems WP Banner, SB Hadiashar, G Mazur, T Menke, M Ziolkowski, K Kennedy, ... arXiv preprint arXiv:2305.02179, 2023 | 3 | 2023 |
Thomas KjærgaardPost Doc, qLEAP center for theoretical chemistry, Aarhus UniversityVerified email at chem.au.dk