Runeson JE - Search Results

1

Which Algorithm Best Propagates the Meyer-Miller-Stock-Thoss Mapping Hamiltonian for Non-Adiabatic Dynamics?

Cook LE, Runeson JE, Richardson JO, Hele TJH. Cook LE, et al. Among authors: runeson je. J Chem Theory Comput. 2023 Sep 26;19(18):6109-6125. doi: 10.1021/acs.jctc.3c00709. Epub 2023 Sep 13. J Chem Theory Comput. 2023. PMID: 37704193 Free PMC article.

2

Spin-mapping approach for nonadiabatic molecular dynamics.

Runeson JE, Richardson JO. Runeson JE, et al. J Chem Phys. 2019 Jul 28;151(4):044119. doi: 10.1063/1.5100506. J Chem Phys. 2019. PMID: 31370524

3

Generalized spin mapping for quantum-classical dynamics.

Runeson JE, Richardson JO. Runeson JE, et al. J Chem Phys. 2020 Feb 28;152(8):084110. doi: 10.1063/1.5143412. J Chem Phys. 2020. PMID: 32113368

4

Quantum Entanglement from Classical Trajectories.

Runeson JE, Richardson JO. Runeson JE, et al. Phys Rev Lett. 2021 Dec 17;127(25):250403. doi: 10.1103/PhysRevLett.127.250403. Phys Rev Lett. 2021. PMID: 35029436

5

On detailed balance in nonadiabatic dynamics: From spin spheres to equilibrium ellipsoids.

Amati G, Runeson JE, Richardson JO. Amati G, et al. Among authors: runeson je. J Chem Phys. 2023 Feb 14;158(6):064113. doi: 10.1063/5.0137828. J Chem Phys. 2023. PMID: 36792511

6

Explaining the Efficiency of Photosynthesis: Quantum Uncertainty or Classical Vibrations?

Runeson JE, Lawrence JE, Mannouch JR, Richardson JO. Runeson JE, et al. J Phys Chem Lett. 2022 Apr 21;13(15):3392-3399. doi: 10.1021/acs.jpclett.2c00538. Epub 2022 Apr 11. J Phys Chem Lett. 2022. PMID: 35404611 Free PMC article.

7

How Quantum is the Resonance Behavior in Vibrational Polariton Chemistry?

Fiechter MR, Runeson JE, Lawrence JE, Richardson JO. Fiechter MR, et al. Among authors: runeson je. J Phys Chem Lett. 2023 Sep 14;14(36):8261-8267. doi: 10.1021/acs.jpclett.3c01154. Epub 2023 Sep 7. J Phys Chem Lett. 2023. PMID: 37676159 Free PMC article.

8

A multi-state mapping approach to surface hopping.

Runeson JE, Manolopoulos DE. Runeson JE, et al. J Chem Phys. 2023 Sep 7;159(9):094115. doi: 10.1063/5.0158147. J Chem Phys. 2023. PMID: 37675848

9

Quantum Symmetry from Enhanced Sampling Methods.

Runeson J, Nava M, Parrinello M. Runeson J, et al. Phys Rev Lett. 2018 Oct 5;121(14):140602. doi: 10.1103/PhysRevLett.121.140602. Phys Rev Lett. 2018. PMID: 30339452

10

Charge transport in organic semiconductors from the mapping approach to surface hopping.

Runeson JE, Drayton TJG, Manolopoulos DE. Runeson JE, et al. J Chem Phys. 2024 Oct 14;161(14):144102. doi: 10.1063/5.0226001. J Chem Phys. 2024. PMID: 39377321

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