| Observation of the molecular response to light upon photoexcitation H Yong, N Zotev, JM Ruddock, B Stankus, M Simmermacher, ... Nature Communications 11 (1), 2157, 2020 | 57 | 2020 |
| Electronic coherence in ultrafast X-ray scattering from molecular wave packets M Simmermacher, NE Henriksen, KB Møller, AM Carrascosa, A Kirrander Physical Review Letters 122 (7), 073003, 2019 | 54 | 2019 |
| Theory of ultrafast x-ray scattering by molecules in the gas phase M Simmermacher, A Moreno Carrascosa, NE Henriksen, KB Møller, ... The Journal of Chemical Physics 151 (17), 174302, 2019 | 32 | 2019 |
| Azadioxatriangulenium and Diazaoxatriangulenium: Quantum Yields and Fundamental Photophysical Properties SA Bogh, M Simmermacher, M Westberg, M Bregnhøj, M Rosenberg, ... ACS Omega 2 (1), 193–203, 2017 | 30 | 2017 |
| Excited electronic states in total isotropic scattering from molecules N Zotev, A Moreno Carrascosa, M Simmermacher, A Kirrander Journal of Chemical Theory and Computation 16 (4), 2594–2605, 2020 | 26 | 2020 |
| Time-resolved X-ray scattering by electronic wave packets: analytic solutions to the hydrogen atom M Simmermacher, NE Henriksen, KB Møller Physical Chemistry Chemical Physics 19 (30), 19740–19749, 2017 | 19 | 2017 |
| Single-molecule detection of a fluorescent nucleobase analogue via multiphoton excitation D Nobis, RS Fisher, M Simmermacher, PA Hopkins, Y Tor, AC Jones, ... The Journal of Physical Chemistry Letters 10 (17), 5008–5012, 2019 | 18 | 2019 |
| The Second-Order-Polarization-Propagator-Approximation (SOPPA) in a four-component spinor basis AK Schnack-Petersen, M Simmermacher, E Fasshauer, HJA Jensen, ... The Journal of Chemical Physics 152 (13), 134113, 2020 | 16 | 2020 |
| How to excite nuclear wavepackets into electronically degenerate states in spin-vibronic quantum dynamics simulations M Pápai, M Simmermacher, TJ Penfold, KB Møller, T Rozgonyi Journal of Chemical Theory and Computation 14 (8), 3967–3974, 2018 | 15 | 2018 |
| CarbX: A program for the evaluation of wide-angle X-ray scattering data of non-graphitic carbons T Pfaff, M Simmermacher, BM Smarsly Journal of Applied Crystallography 51 (1), 219–229, 2018 | 13 | 2018 |
| Efficient Computation of Two-Electron Reduced Density Matrices via Selected Configuration Interaction JP Coe, A Moreno Carrascosa, M Simmermacher, A Kirrander, ... Journal of Chemical Theory and Computation 18 (11), 6690–6699, 2022 | 10 | 2022 |
| Towards high-resolution X-ray scattering as a probe of electron correlation AM Carrascosa, JP Coe, M Simmermacher, MJ Paterson, A Kirrander Physical Chemistry Chemical Physics 24 (39), 24542–24552, 2022 | 9 | 2022 |
| Time-resolved x-ray scattering from impulsively aligned or oriented molecules M Simmermacher, A Kirrander, NE Henriksen Physical Review A 102 (5), 052825, 2020 | 7 | 2020 |
| Solution Manual to Molecular Electromagnetism. A Computational Chemistry Approach SPA Sauer, R Faber, NH List, K Mackeprang, N Wahlberg, ... Oxford University Press, Oxford, 2015 | 7 | 2015 |
| The contribution of Compton ionization to ultrafast x-ray scattering KM Ziems, M Simmermacher, S Gräfe, A Kirrander The Journal of Chemical Physics 159 (4), 044108, 2023 | 4 | 2023 |
| Time-resolved diffraction: general discussion F Allum, K Amini, M Ashfold, D Bansal, RJF Berger, M Centurion, G Dixit, ... Faraday Discussions 228, 161–190, 2021 | 3 | 2021 |
| Theory of Time-dependent Scattering M Simmermacher, PM Weber, A Kirrander | 2 | 2023 |
| Using a multistate Mapping Approach to Surface Hopping to predict the Ultrafast Electron Diffraction signal of gas-phase cyclobutanone L Hutton, AM Carrascosa, AW Prentice, M Simmermacher, JE Runeson, ... arXiv preprint arXiv:2402.10195, 2024 | | 2024 |
| Theory and Simulations of Time-Resolved X-Ray Scattering M Simmermacher Technical University of Denmark, 2018 | | 2018 |
Adam KirranderUniversity of OxfordDirección de correo verificada de chem.ox.ac.uk
