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Nature Communications
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August 30, 2020
Anharmonic quantum nuclear densities from full dimensional vibrational eigenfunctions with application to protonated glycine
Chiara Aieta, Marco Micciarelli, Gianluca Bertaina, et al.
The Journal of Chemical Physics
|
August 17, 2018
Anharmonic vibrational eigenfunctions and infrared spectra from semiclassical molecular dynamics
Marco Micciarelli, Riccardo Conte, Jaime Suarez, et al.
The Journal of Physical Chemistry Letters
|
July 18, 2024
A Perspective on the Investigation of Spectroscopy and Kinetics of Complex Molecular Systems with Semiclassical Approaches
Riccardo Conte, Chiara Aieta, Marco Cazzaniga, et al.
The Journal of Chemical Physics
|
March 11, 2026
Nuclear quantum effects in condensed phase: The case of the "association band" of liquid water
Marco Cazzaniga, Davide Moscato, Riccardo Conte, et al.
Journal of Chemical Theory and Computation
|
December 2, 2015
Accelerated Superposition State Molecular Dynamics for Condensed Phase Systems
Michele Ceotto, Gary S Ayton, Gregory A Voth
The Journal of Chemical Physics
|
December 9, 2020
Representing molecular ground and excited vibrational eigenstates with nuclear densities obtained from semiclassical initial value representation molecular dynamics
Chiara Aieta, Gianluca Bertaina, Marco Micciarelli, et al.
The Journal of Chemical Physics
|
December 14, 2011
Fighting the curse of dimensionality in first-principles semiclassical calculations: non-local reference states for large number of dimensions
Michele Ceotto, Gian Franco Tantardini, Alán Aspuru-Guzik
The Journal of Chemical Physics
|
July 9, 2025
An extended semiclassical initial value representation approach to IR spectroscopy
Cecilia Lanzi, Chiara Aieta, Michele Ceotto, et al.
Chemical Science
|
December 14, 2018
Protonated glycine supramolecular systems: the need for quantum dynamics
Fabio Gabas, Giovanni Di Liberto, Riccardo Conte, et al.
The Journal of Chemical Physics
|
May 10, 2014
Graphics processing units accelerated semiclassical initial value representation molecular dynamics
Dario Tamascelli, Francesco Saverio Dambrosio, Riccardo Conte, et al.
Page
of 7
Search research articles
Search
Showing results (41-50 of 70) with videos related to
Sort By:
Page
of 7
Nature Communications
|
August 30, 2020
Anharmonic quantum nuclear densities from full dimensional vibrational eigenfunctions with application to protonated glycine
Chiara Aieta, Marco Micciarelli, Gianluca Bertaina, et al.
The Journal of Chemical Physics
|
August 17, 2018
Anharmonic vibrational eigenfunctions and infrared spectra from semiclassical molecular dynamics
Marco Micciarelli, Riccardo Conte, Jaime Suarez, et al.
The Journal of Physical Chemistry Letters
|
July 18, 2024
A Perspective on the Investigation of Spectroscopy and Kinetics of Complex Molecular Systems with Semiclassical Approaches
Riccardo Conte, Chiara Aieta, Marco Cazzaniga, et al.
The Journal of Chemical Physics
|
March 11, 2026
Nuclear quantum effects in condensed phase: The case of the "association band" of liquid water
Marco Cazzaniga, Davide Moscato, Riccardo Conte, et al.
Journal of Chemical Theory and Computation
|
December 2, 2015
Accelerated Superposition State Molecular Dynamics for Condensed Phase Systems
Michele Ceotto, Gary S Ayton, Gregory A Voth
The Journal of Chemical Physics
|
December 9, 2020
Representing molecular ground and excited vibrational eigenstates with nuclear densities obtained from semiclassical initial value representation molecular dynamics
Chiara Aieta, Gianluca Bertaina, Marco Micciarelli, et al.
The Journal of Chemical Physics
|
December 14, 2011
Fighting the curse of dimensionality in first-principles semiclassical calculations: non-local reference states for large number of dimensions
Michele Ceotto, Gian Franco Tantardini, Alán Aspuru-Guzik
The Journal of Chemical Physics
|
July 9, 2025
An extended semiclassical initial value representation approach to IR spectroscopy
Cecilia Lanzi, Chiara Aieta, Michele Ceotto, et al.
Chemical Science
|
December 14, 2018
Protonated glycine supramolecular systems: the need for quantum dynamics
Fabio Gabas, Giovanni Di Liberto, Riccardo Conte, et al.
The Journal of Chemical Physics
|
May 10, 2014
Graphics processing units accelerated semiclassical initial value representation molecular dynamics
Dario Tamascelli, Francesco Saverio Dambrosio, Riccardo Conte, et al.
Page
of 7