Projects per year
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Collaborations and top research areas from the last five years
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Photoinduced Proton-Coupled Electron or Energy Transfer
Hammes-Schiffer, S. (PI)
NSF - National Science Foundation
8/1/24 → 7/31/27
Project: Research project
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Multiscale Nuclear-Electronic Orbital Quantum Dynamics in Complex Environments
Hammes-Schiffer, S. (PI)
3/1/24 → 8/31/25
Project: Research project
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Coupled Protons and Electrons in Biological Systems
Hammes-Schiffer, S. (PI)
1/3/24 → 12/31/25
Project: Research project
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Collaborative Research: Frameworks: Sustainable Open-Source Quantum Dynamics and Spectroscopy Software
Hammes-Schiffer, S. (PI)
NSF - National Science Foundation
11/1/23 → 7/31/27
Project: Research project
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Non-Born-Oppenheimer Effects in the Framework of Multicomponent Time-Dependent Density Functional Theory
Hammes-Schiffer, S. (PI)
NSF - National Science Foundation
1/15/24 → 7/31/24
Project: Research project
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Drug binding disrupts chiral water structures in the DNA first hydration shell
Santiago, T., Konstantinovsky, D., Tremblay, M., Perets, E. A., Hammes-Schiffer, S. & Yan, E. C. Y., 2025, (Accepted/In press) In: Chemical Science.Research output: Contribution to journal › Article › peer-review
Open Access -
Hydrogen Tunneling and Conformational Motions in Nonadiabatic Proton-Coupled Electron Transfer between Interfacial Tyrosines in Ribonucleotide Reductase
Zhong, J., Zhu, Q., Soudackov, A. V. & Hammes-Schiffer, S., Feb 5 2025, In: Journal of the American Chemical Society. 147, 5, p. 4459-4468 10 p.Research output: Contribution to journal › Article › peer-review
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Time-resolved vibronic spectra with nuclear-electronic orbital time-dependent configuration interaction
Garner, S. M., Upadhyay, S., Li, X. & Hammes-Schiffer, S., Jan 28 2025, In: Journal of Chemical Physics. 162, 4, 044108.Research output: Contribution to journal › Article › peer-review
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A Many-Body Perspective of Nuclear Quantum Effects in Aqueous Clusters
Lambros, E., Fetherolf, J. H., Hammes-Schiffer, S. & Li, X., Apr 18 2024, In: Journal of Physical Chemistry Letters. 15, 15, p. 4070-4075 6 p.Research output: Contribution to journal › Article › peer-review
1 Scopus citations -
Beyond the “spine of hydration”: Chiral SFG spectroscopy detects DNA first hydration shell and base pair structures
Perets, E. A., Konstantinovsky, D., Santiago, T., Videla, P. E., Tremblay, M., Velarde, L., Batista, V. S., Hammes-Schiffer, S. & Yan, E. C. Y., Sep 7 2024, In: Journal of Chemical Physics. 161, 9, 095104.Research output: Contribution to journal › Article › peer-review
Open Access4 Scopus citations