Overview
Contributors
CEOTTO MICHELE
Scientific Manager
Departments involved
Dipartimento di Chimica
Principale
Type
FARE -FARE Ricerca in Italia
Funder
MINISTERO DELL'ISTRUZIONE E DEL MERITO
Date/time interval
January 1, 2018 - December 31, 2021
Project duration
48 months
Publications
Outputs (3)
On-the-fly adiabatically switched semiclassical initial value representation molecular dynamics for vibrational spectroscopy of biomolecules
THE JOURNAL OF CHEMICAL PHYSICSAMERICAN INSTITUTE OF PHYSICS
2021
Academic Article
Open Access
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Sensitivity of semiclassical vibrational spectroscopy to potential energy surface accuracy: A test on formaldehyde.
VIBRATIONAL SPECTROSCOPYELSEVIER
2020
Academic Article
Partially Open Access
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Improved semiclassical dynamics through adiabatic switching trajectory sampling
THE JOURNAL OF CHEMICAL PHYSICSAMERICAN INSTITUTE OF PHYSICS
2019
Academic Article
Partially Open Access
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