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Physical Review Letters
|
December 19, 2025
Twin Polaritons: Classical versus Quantum Features in Polaritonic Spectra
Irén Simkó, Norah M Hoffmann
The Journal of Physical Chemistry. A
|
September 16, 2024
Intermolecular Bending States and Tunneling Splittings of Water Trimer from Rigorous 9D Quantum Calculations: I. Methodology, Energy Levels, and Low-Frequency Spectrum
Peter M Felker, Irén Simkó, Zlatko Bačić
Journal of Chemical Theory and Computation
|
May 31, 2019
Toward Automated Variational Computation of Rovibrational Resonances, Including a Case Study of the H<sub>2</sub> Dimer
Irén Simkó, Tamás Szidarovszky, Attila G Császár
Journal of Chemical Theory and Computation
|
December 19, 2022
Quantum-Chemical and Quantum-Graph Models of the Dynamical Structure of CH<sub>5</sub><sup></sup>
Irén Simkó, Csaba Fábri, Attila G Császár
The Journal of Chemical Physics
|
January 15, 2025
H2O trimer: Rigorous 12D quantum calculations of intermolecular vibrational states, tunneling splittings, and low-frequency spectrum
Irén Simkó, Peter M Felker, Zlatko Bačić
Journal of Chemical Theory and Computation
|
November 30, 2023
Unusual Dynamics and Vibrational Fingerprints of van der Waals Dimers Formed by Linear Molecules and Rare-Gas Atoms
Roland Tóbiás, Irén Simkó, Attila G Császár
The Journal of Chemical Physics
|
April 22, 2024
HCl trimer: HCl-stretch excited intramolecular and intermolecular vibrational states from 12D fully coupled quantum calculations employing contracted intra- and inter-molecular bases
Irén Simkó, Peter M Felker, Zlatko Bačić
The Journal of Chemical Physics
|
November 13, 2025
D2O trimer: Intermolecular vibration-tunneling states, low-frequency spectrum, and the effects of the three-body interactions from rigorous 12D quantum calculations
Irén Simkó, Peter M Felker, Zlatko Bačić
The Journal of Chemical Physics
|
July 15, 2025
Intermolecular bending states and tunneling splittings of water trimer from rigorous 9D quantum calculations. II. Characterization of the states
Peter M Felker, Irén Simkó, Zlatko Bačić
Scientific Reports
|
May 18, 2022
Achieving high molecular alignment and orientation for CH[Formula: see text]F through manipulation of rotational states with varying optical and THz laser pulse parameters
Kalyani Chordiya, Irén Simkó, Tamás Szidarovszky, et al.
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Search research articles
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Showing results (1-10 of 17) with videos related to
Sort By:
Page
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Physical Review Letters
|
December 19, 2025
Twin Polaritons: Classical versus Quantum Features in Polaritonic Spectra
Irén Simkó, Norah M Hoffmann
The Journal of Physical Chemistry. A
|
September 16, 2024
Intermolecular Bending States and Tunneling Splittings of Water Trimer from Rigorous 9D Quantum Calculations: I. Methodology, Energy Levels, and Low-Frequency Spectrum
Peter M Felker, Irén Simkó, Zlatko Bačić
Journal of Chemical Theory and Computation
|
May 31, 2019
Toward Automated Variational Computation of Rovibrational Resonances, Including a Case Study of the H<sub>2</sub> Dimer
Irén Simkó, Tamás Szidarovszky, Attila G Császár
Journal of Chemical Theory and Computation
|
December 19, 2022
Quantum-Chemical and Quantum-Graph Models of the Dynamical Structure of CH<sub>5</sub><sup></sup>
Irén Simkó, Csaba Fábri, Attila G Császár
The Journal of Chemical Physics
|
January 15, 2025
H2O trimer: Rigorous 12D quantum calculations of intermolecular vibrational states, tunneling splittings, and low-frequency spectrum
Irén Simkó, Peter M Felker, Zlatko Bačić
Journal of Chemical Theory and Computation
|
November 30, 2023
Unusual Dynamics and Vibrational Fingerprints of van der Waals Dimers Formed by Linear Molecules and Rare-Gas Atoms
Roland Tóbiás, Irén Simkó, Attila G Császár
The Journal of Chemical Physics
|
April 22, 2024
HCl trimer: HCl-stretch excited intramolecular and intermolecular vibrational states from 12D fully coupled quantum calculations employing contracted intra- and inter-molecular bases
Irén Simkó, Peter M Felker, Zlatko Bačić
The Journal of Chemical Physics
|
November 13, 2025
D2O trimer: Intermolecular vibration-tunneling states, low-frequency spectrum, and the effects of the three-body interactions from rigorous 12D quantum calculations
Irén Simkó, Peter M Felker, Zlatko Bačić
The Journal of Chemical Physics
|
July 15, 2025
Intermolecular bending states and tunneling splittings of water trimer from rigorous 9D quantum calculations. II. Characterization of the states
Peter M Felker, Irén Simkó, Zlatko Bačić
Scientific Reports
|
May 18, 2022
Achieving high molecular alignment and orientation for CH[Formula: see text]F through manipulation of rotational states with varying optical and THz laser pulse parameters
Kalyani Chordiya, Irén Simkó, Tamás Szidarovszky, et al.
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of 2