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The Journal of Chemical Physics
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November 4, 2017
Application of the mixed time-averaging semiclassical initial value representation method to complex molecular spectra
Max Buchholz, Frank Grossmann, Michele Ceotto
Journal of Chemical Theory and Computation
|
May 11, 2017
On-the-Fly ab Initio Semiclassical Calculation of Glycine Vibrational Spectrum
Fabio Gabas, Riccardo Conte, Michele Ceotto
The Journal of Chemical Physics
|
March 9, 2021
Caldeira-Leggett model vs ab initio potential: A vibrational spectroscopy test of water solvation
Alessandro Rognoni, Riccardo Conte, Michele Ceotto
The Journal of Chemical Physics
|
December 23, 2021
On-the-fly adiabatically switched semiclassical initial value representation molecular dynamics for vibrational spectroscopy of biomolecules
Giacomo Botti, Michele Ceotto, Riccardo Conte
Chemical Science
|
November 19, 2025
Solvation or not solvation: tunneling reactions of molecules embedded in cryogenic matrices
Giacomo Mandelli, Chiara Aieta, Michele Ceotto
Journal of Chemical Theory and Computation
|
September 12, 2024
Is Quantum Above-Barrier Reflection Important for Molecular Barrier Crossing Rates?
Chiara Aieta, Michele Ceotto, Eli Pollak
The Journal of Physical Chemistry. A
|
May 24, 2014
Helium isotope enrichment by resonant tunneling through nanoporous graphene bilayers
Salvatore Mandrà, Joshua Schrier, Michele Ceotto
The Journal of Physical Chemistry Letters
|
September 28, 2023
Investigating the Spectroscopy of the Gas Phase Guanine-Cytosine Pair: Keto versus Enol Configurations
Giacomo Botti, Michele Ceotto, Riccardo Conte
The Journal of Chemical Physics
|
March 10, 2016
Mixed semiclassical initial value representation time-averaging propagator for spectroscopic calculations
Max Buchholz, Frank Grossmann, Michele Ceotto
The Journal of Physical Chemistry. A
|
February 4, 2016
An Efficient Computational Approach for the Calculation of the Vibrational Density of States
Chiara Aieta, Fabio Gabas, Michele Ceotto
Page
of 7
Search research articles
Search
Showing results (11-20 of 70) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
November 4, 2017
Application of the mixed time-averaging semiclassical initial value representation method to complex molecular spectra
Max Buchholz, Frank Grossmann, Michele Ceotto
Journal of Chemical Theory and Computation
|
May 11, 2017
On-the-Fly ab Initio Semiclassical Calculation of Glycine Vibrational Spectrum
Fabio Gabas, Riccardo Conte, Michele Ceotto
The Journal of Chemical Physics
|
March 9, 2021
Caldeira-Leggett model vs ab initio potential: A vibrational spectroscopy test of water solvation
Alessandro Rognoni, Riccardo Conte, Michele Ceotto
The Journal of Chemical Physics
|
December 23, 2021
On-the-fly adiabatically switched semiclassical initial value representation molecular dynamics for vibrational spectroscopy of biomolecules
Giacomo Botti, Michele Ceotto, Riccardo Conte
Chemical Science
|
November 19, 2025
Solvation or not solvation: tunneling reactions of molecules embedded in cryogenic matrices
Giacomo Mandelli, Chiara Aieta, Michele Ceotto
Journal of Chemical Theory and Computation
|
September 12, 2024
Is Quantum Above-Barrier Reflection Important for Molecular Barrier Crossing Rates?
Chiara Aieta, Michele Ceotto, Eli Pollak
The Journal of Physical Chemistry. A
|
May 24, 2014
Helium isotope enrichment by resonant tunneling through nanoporous graphene bilayers
Salvatore Mandrà, Joshua Schrier, Michele Ceotto
The Journal of Physical Chemistry Letters
|
September 28, 2023
Investigating the Spectroscopy of the Gas Phase Guanine-Cytosine Pair: Keto versus Enol Configurations
Giacomo Botti, Michele Ceotto, Riccardo Conte
The Journal of Chemical Physics
|
March 10, 2016
Mixed semiclassical initial value representation time-averaging propagator for spectroscopic calculations
Max Buchholz, Frank Grossmann, Michele Ceotto
The Journal of Physical Chemistry. A
|
February 4, 2016
An Efficient Computational Approach for the Calculation of the Vibrational Density of States
Chiara Aieta, Fabio Gabas, Michele Ceotto
Page
of 7