F. Gabas

University of Milan — Italy

Physics and Astronomy · Physical Sciences

10h-index351citations27works0.02yr avg
OpenAlex↗ORCID↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Advanced Chemical Physics Studies(18), Spectroscopy and Quantum Chemical Studies(14), Molecular Spectroscopy and Structure(8), Spectroscopy and Laser Applications(6), Molecular spectroscopy and chirality(4)

Publications27 total

Vibrational spectroscopy simulation of solvation effects on a G-quadruplex
Journal of Biomolecular Structure and Dynamics·2023· 10 citedOpen Access
Quantum Anharmonic Calculations of Vibrational Spectra for Water Adsorbed on Titania Anatase(101) Surface: Dissociative versus Molecular Adsorption
The Journal of Physical Chemistry C·2022· 11 citedOpen Access
Quantum Vibrational Spectroscopy of Explicitly Solvated Thymidine in Semiclassical Approximation
The Journal of Physical Chemistry Letters·2022· 8 citedOpen Access
Semiclassical Initial Value Representation Molecular Dynamics for Spectroscopy
2021
Anharmonic calculations of vibrational spectra for molecular adsorbates : A divide-and-conquer semiclassical molecular dynamics approach
2021
Semiclassical Vibrational Spectroscopy of Biological Molecules Using Force Fields
Journal of Chemical Theory and Computation·2020· 25 citedOpen Access
Anharmonic calculations of vibrational spectra for molecular adsorbates: A divide-and-conquer semiclassical molecular dynamics approach
The Journal of Chemical Physics·2020· 24 citedOpen Access
Semiclassical Molecular Dynamics : a useful Tool for Spectroscopic Interpretation
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Semiclassical vibrational spectroscopy with Hessian databases
The Journal of Chemical Physics·2019· 28 citedOpen Access
Parallel Implementation of Semiclassical Transition State Theory and its application to high-dimensional tunneling reactions
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Semiclassical molecular dynamics for spectroscopic calculations of high dimensional and condensed phase molecular systems
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Vibrational investigation of nucleobases by means of divide and conquer semiclassical dynamics
The Journal of Chemical Physics·2019· 30 citedOpen Access
Parallel Implementation of Semiclassical Transition State Theory
Journal of Chemical Theory and Computation·2019· 21 citedOpen Access
Semiclassical Molecular Dynamics and its Implementation for Spectroscopic Calculations of High Dimensional and Condensed Phase Molecular Systems
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Quantum Mechanical Methods for Spectroscopic Calculations of High Dimensional Molecular Systems
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
IMPLEMENTATION OF SEMICLASSICAL THEORIES FOR SPECTROSCOPY
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Semiclassical Molecular Dynamics for Spectroscopic Calculations of Complex Systems
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2019Open Access
Semiclassical Methods for Spectroscopic Calculations of High Dimensional Molecular Systems
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2018Open Access
Ab-initio and force field molecular dynamics applied to vibrational spectroscopy: the case of Deoxyguanosine and Ac-Phe-Met-NH2
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2018Open Access
Deoxyguanosine and Ac-Phe-Met-NH2 vibrational spectra: a comparison between ab-initio and force field molecular dynamics
Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)·2018Open Access
page 1 of 2Next →

Frequent Co-authors

Michele Ceotto(25), Riccardo Conte(18), Giovanni Di Liberto(10), Marco Micciarelli(9), Chiara Aieta(7), Marco Cazzaniga(6), M. Buchholz(6), Frank Großmann(4), Gianluca Bertaina(4), J. Suarez Corujo(3), Giacomo Botti(2), Agnes Mahmoud(2), and Jaime Suarez(2), Gerard W. Frank(2), Alessandra Forni(1), Stefano Pieraccini(1), Stefano Rendine(1), Maurizio Sironi(1), Yu Zhuang(1), Francesco Moriggi(1)