| A modified approach for simulating electronically nonadiabatic dynamics via the generalized quantum master equation E Mulvihill, A Schubert, X Sun, BD Dunietz, E Geva The Journal of Chemical Physics 150 (3), 2019 | 46 | 2019 |
| Combining the mapping Hamiltonian linearized semiclassical approach with the generalized quantum master equation to simulate electronically nonadiabatic molecular dynamics E Mulvihill, X Gao, Y Liu, A Schubert, BD Dunietz, E Geva The Journal of chemical physics 151 (7), 2019 | 42 | 2019 |
| Electronic dynamics through conical intersections via quasiclassical mapping Hamiltonian methods Y Liu, X Gao, Y Lai, E Mulvihill, E Geva Journal of Chemical Theory and Computation 16 (7), 4479-4488, 2020 | 32 | 2020 |
| Simulating energy transfer dynamics in the Fenna–Matthews–Olson complex via the modified generalized quantum master equation E Mulvihill, KM Lenn, X Gao, A Schubert, BD Dunietz, E Geva The Journal of Chemical Physics 154 (20), 2021 | 26 | 2021 |
| A road map to various pathways for calculating the memory kernel of the generalized quantum master equation E Mulvihill, E Geva The Journal of Physical Chemistry B 125 (34), 9834-9852, 2021 | 20 | 2021 |
| Simulating open quantum system dynamics on NISQ computers with generalized quantum master equations Y Wang, E Mulvihill, Z Hu, N Lyu, S Shivpuje, Y Liu, MB Soley, E Geva, ... Journal of Chemical Theory and Computation 19 (15), 4851-4862, 2023 | 18 | 2023 |
| Simulating the dynamics of electronic observables via reduced-dimensionality generalized quantum master equations E Mulvihill, E Geva The Journal of Chemical Physics 156 (4), 2022 | 14 | 2022 |
| Tensor-train thermo-field memory kernels for generalized quantum master equations N Lyu, E Mulvihill, MB Soley, E Geva, VS Batista Journal of Chemical Theory and Computation 19 (4), 1111-1129, 2023 | 11 | 2023 |
| Compute-to-learn: Authentic learning via development of interactive computer demonstrations within a peer-led studio environment M Jafari, AR Welden, KL Williams, B Winograd, E Mulvihill, ... Journal of Chemical Education 94 (12), 1896-1903, 2017 | 11 | 2017 |
| Simulation of open quantum system dynamics based on the generalized quantum master equation on quantum computing devices Y Wang, E Mulvihill, Z Hu, N Lyu, S Shivpuje, Y Liu, M Soley, E Geva, ... APS March Meeting Abstracts 2023, LL08. 004, 2023 | 5 | 2023 |
| The Compute-to-Learn Pedagogy and Its Implementation in the Chemistry Curriculum HP Hendrickson, KM Lenn, FX Vazquez, KL Williams, BA Winograd, ... Teaching Programming across the Chemistry Curriculum, 69-87, 2021 | 1 | 2021 |
| Simulating Electronically Nonadiabatic Dynamics via the Generalized Quantum Master Equation E Mulvihill | 1 | 2020 |
| Supplementary Information: Simulating Open Quantum System Dynamics on NISQ Computers with Generalized Quantum Master Equations Y Wang, E Mulvihill, Z Hu, N Lyu, S Shivpuje, Y Liu, MB Soley, E Geva, ... | | 2023 |
| Modeling Exciton Transport in the Photosystem II Reaction Center via the Modified Generalized Quantum Master Equation K Lenn, E Mulvihill, X Gao, A Schubert, E Geva Bulletin of the American Physical Society 65, 2020 | | 2020 |
| Modeling the quantum dynamics behind charge transport in photosynthetic reaction centers beyond the Spin-Boson model K Lenn, E Geva, E Mulvihill ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
| Post-Marcus electronic transition dynamics via the generalized quantum master equation: A new approach E Mulvihill, A Schubert, X Sun, Y Lai, E Geva ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
| Post-Marcus charge transfer dynamics via the generalized quantum master equation E Mulvihill, E Geva, A Schubert, X Sun, A Kananenka ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 253, 2017 | | 2017 |
