| Acetylacetone photodynamics at a seeded free-electron laser RJ Squibb, M Sapunar, A Ponzi, R Richter, A Kivimäki, O Plekan, P Finetti, ... Nature Communications 9 (1), 63, 2018 | 77 | 2018 |
| Assessing the performance of trajectory surface hopping methods: Ultrafast internal conversion in pyrazine W Xie, M Sapunar, N Došlić, M Sala, W Domcke The Journal of Chemical Physics 150 (15), 154119, 2019 | 61 | 2019 |
| Timescales of N–H bond dissociation in pyrrole: a nonadiabatic dynamics study M Sapunar, A Ponzi, S Chaiwongwattana, M Mališ, A Prlj, P Decleva, ... Physical Chemistry Chemical Physics 17 (29), 19012-19020, 2015 | 48 | 2015 |
| Exploration of excited state deactivation pathways of adenine monohydrates S Chaiwongwattana, M Sapunar, A Ponzi, P Decleva, N Došlić The Journal of Physical Chemistry A 119 (43), 10637-10644, 2015 | 37 | 2015 |
| Fine-tuning the effect of π–π interactions on the stability of the N TB phase A Knežević, M Sapunar, A Buljan, I Dokli, Z Hameršak, D Kontrec, ... Soft Matter 14 (42), 8466-8474, 2018 | 32 | 2018 |
| Toward understanding optical properties of amyloids: a reaction path and nonadiabatic dynamics study L Grisanti, M Sapunar, A Hassanali, N Došlić Journal of the American Chemical Society 142 (42), 18042-18049, 2020 | 31 | 2020 |
| Highly efficient algorithms for CIS type excited state wave function overlaps M Sapunar, T Piteša, D Davidović, N Došlić Journal of chemical theory and computation 15 (6), 3461-3469, 2019 | 31 | 2019 |
| UV absorption spectra of DNA bases in the 350–190 nm range: Assignment and state specific analysis of solvation effects M Sapunar, W Domcke, N Došlić Physical Chemistry Chemical Physics 21 (41), 22782-22793, 2019 | 22 | 2019 |
| Photoionization of furan from the ground and excited electronic states A Ponzi, M Sapunar, C Angeli, R Cimiraglia, N Došlić, P Decleva The Journal of Chemical Physics 144 (8), 2016 | 22 | 2016 |
| Induced smectic phase in binary mixtures of twist-bend nematogens A Knežević, I Dokli, M Sapunar, S Šegota, U Baumeister, A Lesac Beilstein journal of nanotechnology 9 (1), 1297-1307, 2018 | 21 | 2018 |
| Combined Surface-Hopping, Dyson orbital, and B-Spline approach for the computation of time-resolved photoelectron spectroscopy signals: The internal conversion in pyrazine T Piteša, M Sapunar, A Ponzi, MF Gelin, N Došlić, W Domcke, ... Journal of Chemical Theory and Computation 17 (8), 5098-5109, 2021 | 16 | 2021 |
| Mixed-quantum-classical or fully-quantized dynamics? A unified code to compare methods J Coonjobeeharry, KE Spinlove, C Sanz Sanz, M Sapunar, N Došlić, ... Philosophical Transactions of the Royal Society A 380 (2223), 20200386, 2022 | 11 | 2022 |
| Photochemical deactivation pathways of microsolvated hydroxylamine J Thisuwan, S Chaiwongwattana, M Sapunar, K Sagarik, N Došlić Journal of Photochemistry and Photobiology A: Chemistry 328, 10-15, 2016 | 6 | 2016 |
| Common surface potential of two different crystal planes N Kallay, T Preocˇanin, M Sapunar, D Namjesnik Surface Innovations 2 (3), 142-150, 2014 | 5 | 2014 |
| Excitation and fragmentation of the dielectric gas C4F7N: Electrons vs photons T Ovad, M Sapunar, Š Sršeň, P Slavíček, Z Mašín, NC Jones, ... The Journal of Chemical Physics 158 (1), 2023 | 3 | 2023 |
| Photochemical Ring-Opening Reaction of 1, 3-Cyclohexadiene: Identifying the True Reactive State O Travnikova, T Piteša, A Ponzi, M Sapunar, RJ Squibb, R Richter, ... Journal of the American Chemical Society 144 (48), 21878-21886, 2022 | 3 | 2022 |
| Comparative study of the photodynamics of malonaldehyde and acetylacetone M Sapunar, T Ayari, N Došlić Chemical Physics 515, 622-627, 2018 | 3 | 2018 |
| Efficient update of determinants for many-electron wave function overlaps P Alonso-Jordá, D Davidović, M Sapunar, JR Herrero, ES Quintana-Ortí Computer Physics Communications 258, 107521, 2021 | 2 | 2021 |
| Photoionization of pyrrole from the state: a computational study on the effects of Rydberg–valence mixing A Ponzi, M Sapunar, N Došlić, P Decleva Theoretical Chemistry Accounts 139 (8), 137, 2020 | 2 | 2020 |
| Toolkits for simulation and interpretation of photoinduced processes: a mixed classical-quantum approach M Sapunar University of Zagreb. Faculty of Science. Department of Chemistry, 2021 | 1 | 2021 |
