Michael Schuurman
Affiliations: | Chemistry | University of Ottawa, Ottawa, ON, Canada |
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Parents
Sign in to add mentor| Henry F. Schaefer, III | grad student | University of Georgia | |
| David R. Yarkony | post-doc | Johns Hopkins |
Children
Sign in to add trainee| Ryan J. MacDonell | grad student | 2014-2020 | University of Ottawa |
| Simon Peter Neville | post-doc | University of Ottawa |
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Publications
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| Wang TY, Neville SP, Schuurman MS. (2025) Minimum Energy Conical Intersection Optimization Using DFT/MRCI(2). Journal of Chemical Theory and Computation |
| Costain TS, Rolston JB, Neville SP, et al. (2024) A DFT/MRCI Hamiltonian parameterized using only ab initio data. II. Core-excited states. The Journal of Chemical Physics. 161 |
| Makhija V, Gupta R, Neville S, et al. (2024) Time Resolved Quantum Tomography in Molecular Spectroscopy by the Maximal Entropy Approach. The Journal of Physical Chemistry Letters. 9525-9534 |
| Neville SP, Schuurman MS. (2024) Calculation of quasi-diabatic states within the DFT/MRCI(2) framework: The QD-DFT/MRCI(2) method. The Journal of Chemical Physics. 160 |
| Costain TS, Ogden V, Neville SP, et al. (2024) A DFT/MRCI Hamiltonian parameterized using only ab initio data: I. valence excited states. The Journal of Chemical Physics. 160 |
| Zinchenko KS, Ardana-Lamas F, Lanfaloni VU, et al. (2023) Few-femtosecond electronic and structural rearrangements of driven by the Jahn-Teller effect. Structural Dynamics (Melville, N.Y.). 10: 064303 |
| Morrigan L, Neville SP, Gregory M, et al. (2023) Ultrafast Molecular Frame Quantum Tomography. Physical Review Letters. 131: 193001 |
| Wang TY, Neville SP, Schuurman MS. (2023) Machine Learning Seams of Conical Intersection: A Characteristic Polynomial Approach. The Journal of Physical Chemistry Letters. 14: 7780-7786 |
| Gabalski I, Allum F, Seidu I, et al. (2023) Time-Resolved X-ray Photoelectron Spectroscopy: Ultrafast Dynamics in CS Probed at the S 2p Edge. The Journal of Physical Chemistry Letters. 7126-7133 |
| Neville SP, Schuurman MS. (2022) A perturbative approximation to DFT/MRCI: DFT/MRCI(2). The Journal of Chemical Physics. 157: 164103 |