Gabas Fabio

Type B Postdoctoral Fellow

Contacts

Workplace

Via Golgi, 19 - Corpo B
20133 MILANO (MI)

University email address
Research

Publications

Publications
  • Semiclassical Vibrational Spectroscopy of Biological Molecules Using Force Fields / F. Gabas, R. Conte, M. Ceotto. - In: JOURNAL OF CHEMICAL THEORY AND COMPUTATION. - ISSN 1549-9618. - 16:6(2020 Jun 09), pp. 3476-3485.
  • Anharmonic calculations of vibrational spectra for molecular adsorbates: A divide-and-conquer semiclassical molecular dynamics approach / M. Cazzaniga, M. Micciarelli, F. Moriggi, A. Mahmoud, F. Gabas, M. Ceotto. - In: THE JOURNAL OF CHEMICAL PHYSICS. - ISSN 0021-9606. - 152:10(2020 Mar 14), pp. 104104.1-104104.14.
  • Semiclassical Molecular Dynamics : a useful Tool for Spectroscopic Interpretation / M. Ceotto, R. Conte, G. Di Liberto, F. Gabas, M. Micciarelli, C. Aieta, G. Bertaina, M. Cazzaniga, M. Buchholz, F. Grossmann, J. Suarez Corujo. ((Intervento presentato al convegno VISPEC : International Summer School on Vibrational Spectroscopy tenutosi a Brescia nel 2019.
  • Semiclassical vibrational spectroscopy with Hessian databases / R. Conte, F. Gabas, G. Botti, Y. Zhuang, M. Ceotto. - In: THE JOURNAL OF CHEMICAL PHYSICS. - ISSN 0021-9606. - 150:24(2019 Jun 28).
  • Parallel Implementation of Semiclassical Transition State Theory and its application to high-dimensional tunneling reactions / C. Aieta, F. Gabas, M. Ceotto. ((Intervento presentato al convegno International Workshop on Quantum Atomic and Molecular Tunneling Systems (QAMTS) tenutosi a Borovets nel 2019.