| Benchmarking two-photon absorption cross sections: performance of CC2 and CAM-B3LYP MTP Beerepoot, DH Friese, NH List, J Kongsted, K Ruud Physical Chemistry Chemical Physics 17 (29), 19306-19314, 2015 | 234 | 2015 |
| Benchmarking the performance of exchange-correlation functionals for predicting two-photon absorption strengths MTP Beerepoot, MM Alam, J Bednarska, W Bartkowiak, K Ruud, ... Journal of Chemical Theory and Computation 14 (7), 3677-3685, 2018 | 85 | 2018 |
| Choosing bad versus worse: predictions of two-photon-absorption strengths based on popular density functional approximations M Chołuj, MM Alam, MTP Beerepoot, SP Sitkiewicz, E Matito, K Ruud, ... Journal of chemical theory and computation 18 (2), 1046-1060, 2022 | 77 | 2022 |
| Analysis of computational models for an accurate study of electronic excitations in GFP T Schwabe, MTP Beerepoot, JMH Olsen, J Kongsted Physical Chemistry Chemical Physics 17 (4), 2582-2588, 2015 | 58 | 2015 |
| Averaged solvent embedding potential parameters for multiscale modeling of molecular properties MTP Beerepoot, AH Steindal, NH List, J Kongsted, JMH Olsen Journal of chemical theory and computation 12 (4), 1684-1695, 2016 | 57 | 2016 |
| A polarizable embedding DFT study of one-photon absorption in fluorescent proteins MTP Beerepoot, AH Steindal, J Kongsted, BO Brandsdal, L Frediani, ... Physical Chemistry Chemical Physics 15 (13), 4735-4743, 2013 | 57 | 2013 |
| Intermolecular charge transfer enhances two-photon absorption in yellow fluorescent protein MTP Beerepoot, DH Friese, K Ruud Physical Chemistry Chemical Physics 16 (13), 5958-5964, 2014 | 56 | 2014 |
| Open-ended recursive approach for the calculation of multiphoton absorption matrix elements DH Friese, MTP Beerepoot, M Ringholm, K Ruud Journal of Chemical Theory and Computation 11 (3), 1129-1144, 2015 | 53 | 2015 |
| Convergence of environment polarization effects in multiscale modeling of excitation energies MTP Beerepoot, AH Steindal, K Ruud, JMH Olsen, J Kongsted Computational and Theoretical Chemistry 1040, 304-311, 2014 | 50 | 2014 |
| Rotational averaging of multiphoton absorption cross sections DH Friese, MTP Beerepoot, K Ruud The Journal of Chemical Physics 141 (20), 2014 | 46 | 2014 |
| Formative and summative automated assessment with multiple-choice question banks MTP Beerepoot Journal of Chemical Education 100 (8), 2947-2955, 2023 | 29 | 2023 |
| A computational protocol for vibrational circular dichroism spectra of cyclic oligopeptides KDR Eikås, MTP Beerepoot, K Ruud The Journal of Physical Chemistry A 126 (32), 5458-5471, 2022 | 26 | 2022 |
| Molecular quantum mechanical gradients within the polarizable embedding approach—Application to the internal vibrational Stark shift of acetophenone NH List, MTP Beerepoot, JMH Olsen, B Gao, K Ruud, HJA Jensen, ... The Journal of Chemical Physics 142 (3), 2015 | 26 | 2015 |
| Open-ended response theory with polarizable embedding: multiphoton absorption in biomolecular systems AH Steindal, MTP Beerepoot, M Ringholm, NH List, K Ruud, J Kongsted, ... Physical Chemistry Chemical Physics 18 (40), 28339-28352, 2016 | 25 | 2016 |
| Channel interference in multiphoton absorption MM Alam, MTP Beerepoot, K Ruud The Journal of Chemical Physics 146 (24), 2017 | 22 | 2017 |
| Acetyl group orientation modulates the electronic ground-state asymmetry of the special pair in purple bacterial reaction centers PK Wawrzyniak, MTP Beerepoot, HJM De Groot, F Buda Physical Chemistry Chemical Physics 13 (21), 10270-10279, 2011 | 21 | 2011 |
| Harmonic infrared and Raman spectra in molecular environments using the polarizable embedding model KOHM Dundas, MTP Beerepoot, M Ringholm, S Reine, R Bast, NH List, ... Journal of Chemical theory and Computation 17 (6), 3599-3617, 2021 | 19 | 2021 |
| Electronic circular dichroism of fluorescent proteins: a computational study A Pikulska, AH Steindal, MTP Beerepoot, M Pecul The Journal of Physical Chemistry B 119 (8), 3377-3386, 2015 | 19 | 2015 |
| An averaged polarizable potential for multiscale modeling in phospholipid membranes S Witzke, NH List, JMH Olsen, C Steinmann, M Petersen, MTP Beerepoot, ... Journal of Computational Chemistry 38 (9), 601-611, 2017 | 17 | 2017 |
| A generalized few-state model for the first hyperpolarizability MM Alam, MTP Beerepoot, K Ruud The Journal of Chemical Physics 152 (24), 2020 | 15 | 2020 |
Kenneth RuudHylleraas Centre for Quantum Molecular Sciences, University of Tromsø-The Arctic University ofVerified email at uit.no
