Chirality-Induced Spin Selectivity: Theory and Computation
INVITED · MAR-L12 · ID: 3676143
Presentations
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CISS and a Phase Space Theory of Electronic Structure
ORAL · Invited
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Publication: N.C. Bradbury, T. Duston, Z. Tao, J.I. Rawlinson, R.L. and J.E. Subotnik "Symmetry breaking as predicted by a phase space Hamiltonian with a spin Coriolis potential" J. Chem. Phys. 162, 244107 (2025)
Z Tao, T Duston, Z Pei, Y Shao, J Rawlinson, R Littlejohn, JE Subotnik "An electronic phase-space Hamiltonian approach for electronic current density and vibrational circular dichroism"
J. Chem. Phys. 161, 204107 (2024)
Z Tao, T Qiu, X Bian, T Duston, N Bradbury, JE Subotnik "A Basis-free phase space electronic Hamiltonian that recovers beyond Born–Oppenheimer electronic momentum and current density"
J. Chem. Phys. 162, 144111 (2025)Presenters
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Joseph E Subotnik
- Princeton University
Authors
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Joseph E Subotnik
- Princeton University
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Xuezhi Bian
- Princeton University
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Titouan Duston
- Princeton University
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Nadine Bradbury
- Princeton University
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Zhen Tao
- University of Rhode Island
- The University of Rhode Island
- Princeton University
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Mansi Bhati
- Princeton University
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Tian Qiu
- Princeton University
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Xinchun Wu
- Princeton University
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Yanze Wu
- Northwestern University
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Linqing Peng
- Princeton University
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Unconventional Spintronics from Chiral Perovskites
ORAL · Invited
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Publication: 1. Y. Liu et. al, Adv. Funct Mater. e09127 (2025)
2. I. Zutic et al., Mater. Today 22, 85 (2019)
3. D. Pashov et al., Comput. Phys. Commun. 249,107065 (2020)Presenters
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Igor Zutic
- State Univ of NY - Buffalo
- University at Buffalo, State University of New York
Authors
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Igor Zutic
- State Univ of NY - Buffalo
- University at Buffalo, State University of New York
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Abstract Withdrawn
ORAL · Invited · Withdrawn
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Influence of electronic-vibrational coupling on spin-selectivity in chiral molecular junctions
ORAL · Invited
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Presenters
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Michael Thoss
- University of Freiburg
Authors
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Michael Thoss
- University of Freiburg
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A Molecular Perspective on the CISS Effect
ORAL · Invited
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Publication: [1] Fay, T. P. Chirality-Induced Spin Coherence in Electron Transfer Reactions. J. Phys. Chem. Lett. 12, 1407–1412 (2021).
[2] Fay, T. P. & Limmer, D. T. Origin of Chirality Induced Spin Selectivity in Photoinduced Electron Transfer. Nano Lett. 21, 6696–6702 (2021).
[3] Fay, T. P. & Limmer, D. T. Spin selective charge recombination in chiral donor–bridge–acceptor triads. J. Chem. Phys. 158 194101 (2023)
[4] Fay, T.P. Enantioselective radical reactions can be induced by electron spin polarization: A quantum mechanism for Nature's emergent homochirality? J. Phys. Chem. Lett. 16, 9414–9420 (2025)Presenters
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Thomas P Fay
- University of California, Los Angeles
- UCLA
Authors
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Thomas P Fay
- University of California, Los Angeles
- UCLA
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