Alexei A. Kananenka

University of Delaware — United States

Physics and Astronomy · Physical Sciences

18h-index1.0kcitations51works3.92yr avg
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Research Topics

Spectroscopy and Quantum Chemical Studies(35), Advanced Chemical Physics Studies(16), Quantum, superfluid, helium dynamics(8), Quantum Information and Cryptography(6), Neural Networks and Reservoir Computing(6)

Publications51 total

Theory and Simulations of Fluorescence-Detected Two-Dimensional Electronic Spectroscopy: From Rigorous Quantum Mechanics to Simple Kinetic Models
Journal of Chemical Theory and Computation·2026
A structural model of toxic amyloid oligomers involved in type 2 diabetes
Proceedings of the National Academy of Sciences·2026Open Access
Probing Voltage- and Electrolyte-Dependent Monolayer Dynamics with 2D-IR Spectroscopy
Journal of the American Chemical Society·2025· 1 citedOpen Access
Systematic study of the role of dissipative environment in regulating entanglement and exciton delocalization in the Fenna-Matthews-Olson complex
Physical review. E·2025· 1 cited
A short trajectory is all you need: A transformer-based model for long-time dissipative quantum dynamics
The Journal of Chemical Physics·2024· 8 cited
A short trajectory is all you need: A transformer-based model for long-time dissipative quantum dynamics
arXiv (Cornell University)·2024Open Access
Cavity-Mediated Enhancement of the Energy Transfer in the Reduced Fenna–Matthews–Olson Complex
Journal of Chemical Theory and Computation·2024· 4 cited
Photoexcited Energy Relaxation in Porphyrin Nanorings
The Journal of Physical Chemistry C·2024· 5 cited
Do selectivity filter carbonyls in K+ channels flip away from the pore? Two-dimensional infrared spectroscopy study
Journal of Structural Biology X·2024· 3 citedOpen Access
Elucidating ion configurations and water dynamics in a K+ ion channel using two-dimensional infrared spectroscopy
Biophysical Journal·2024Open Access
Water inside the Selectivity Filter of a K <sup>+</sup> Ion Channel: Structural Heterogeneity, Picosecond Dynamics, and Hydrogen Bonding
Journal of the American Chemical Society·2024· 23 citedOpen Access
A systematic study of the role of dissipative environment in regulating entanglement and exciton delocalization in the Fenna-Matthews-Olson complex
arXiv (Cornell University)·2024· 1 citedOpen Access
Excited-state symmetry breaking is an ultrasensitive tool for probing microscopic electric fields
Chemical Science·2024· 5 citedOpen Access
Water inside the selectivity filter of a K <sup>+</sup> ion channel: structural heterogeneity, picosecond dynamics, and hydrogen-bonding
2023Open Access
Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization
Journal of Chemical Theory and Computation·2023· 6 cited
Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization
2023· 2 citedOpen Access
Probing Ion Configurations in the KcsA Selectivity Filter with Single-Isotope Labels and 2D IR Spectroscopy
Journal of the American Chemical Society·2023· 18 citedOpen Access
QD3SET-1: a database with quantum dissipative dynamics datasets
Frontiers in Physics·2023· 9 citedOpen Access
Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization
2023· 2 citedOpen Access
Combinational Vibration Modes in H<sub>2</sub>O/HDO/D<sub>2</sub>O Mixtures Detected Thanks to the Superior Sensitivity of Femtosecond Stimulated Raman Scattering
The Journal of Physical Chemistry B·2023· 16 citedOpen Access
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Frequent Co-authors

Luis E. Herrera Rodríguez(12), Pavlo O. Dral(9), Kennet J. Rueda Espinosa(8), Dominika Zgid(7), Martin T. Zanni(7), J. L. Skinner(6), Arif Ullah(6), Matthew J. Ryan(5), Lan Nguyen Tran(3), Eitan Geva(3), Ilya G. Ryabinkin(3), Viktor N. Staroverov(3), Lujia Gao(3), Francis I. Valiyaveetil(3), Alexander A. Rusakov(3), Luis E. Herrera Rodr ́ıguez(3), Emanuel Gull(2), Chang-Yu Hsieh(2), Jianshu Cao(2), Jordan J. Phillips(2)