About Me
Education
- Augustus 1996: Ph.D. in Physics, Cornell University, Ithaca, NY, USA
- October 1991: Laurea in Fisica, Universitá di Trento, Italy
Professional employment
- Sep 2009 - ....: Hoogleraar (Full Professor) Universiteit Twente, The Netherlands
- Jan 2006 - Aug 2009: Universitair Docent (Assistant Professor)Instituut-Lorentz, Universiteit Leiden, The Netherlands
- Sep 2001 - Dec 2006: FOM Springplanker (Universitair Docent funded by FOM) Instituut-Lorentz, Universiteit Leiden, The Netherlands
- Sep 1998 - Aug 2001: Lecturer National University of Ireland, Cork, Ireland
- Sep 1996 - Aug 1998: Postdoctoral Research Associate University of Illinois at Urbana-Champaign, USA; Supervisors: Prof. David Ceperley and Prof. Richard Martin
- Jun 1992 - Aug 1996: Graduate Research Assistant Cornell University, USA; Supervisor: Dr. Cyrus Umrigar
- Nov 1991 - May 1992: INFM (National Institute of Condensed Matter Physics) fellow University of Trento, Italy; Supervisor: Prof.Giovanni B. Bachelet
Expertise
Engineering & Materials Science
# Excitation Energy
# Excited States
# Ground State
# Wave Functions
Chemistry
# Excited State
# Wave Function
Physics & Astronomy
# Excitation
# Wave Functions
Organisations
Publications
Recent
Posenitskiy, E., Chilkuri, V. G., Ammar, A., Hapka, M., Pernal, K.
, Shinde, R., Borda, E. J. L.
, Filippi, C., Nakano, K., Kohulák, O., Sorella, S., Castro, P. D. O., Jalby, W., López Ríos, P., Alavi, A., & Scemama, A. (2023).
TREXIO: A file format and library for quantum chemistry.
The Journal of chemical physics,
158(17), [174801].
https://doi.org/10.1063/5.0148161
Posenitskiy, E., Chilkuri, V. G., Ammar, A., Hapka, M., Pernal, K.
, Shinde, R., Borda, E. J. L.
, Filippi, C., Nakano, K., Kohulák, O., Sorella, S., Castro, P. D. O., Jalby, W., Rıós, P. L., Alavi, A., & Scemama, A. (2023).
Trexio : A File Format and Library for Quantum Chemistry. ArXiv.org.
https://doi.org/10.48550/arXiv.2302.14793
Van Rhijn, J.
, Filippi, C., De Palo, S., & Moroni, S. (2022).
Energy Derivatives in Real-Space Diffusion Monte Carlo.
Journal of chemical theory and computation,
18(1), 118-123.
https://doi.org/10.1021/acs.jctc.1c00496
Shepard, S., Panadés-Barrueta, R. L., Moroni, S., Scemama, A.
, & Filippi, C. (2022).
Double Excitation Energies from Quantum Monte Carlo Using State-Specific Energy Optimization.
Journal of chemical theory and computation,
18(11), 6722-6731.
https://doi.org/10.1021/acs.jctc.2c00769
Cuzzocrea, A. (2022).
From vertical excitations towards excited-state relaxation: a journey with quantum Monte Carlo. [PhD Thesis - Research UT, graduation UT, University of Twente]. University of Twente.
https://doi.org/10.3990/1.9789036554947
Cuzzocrea, A., Moroni, S., Scemama, A.
, & Filippi, C. (2022).
Reference Excitation Energies of Increasingly Large Molecules: A QMC Study of Cyanine Dyes.
Journal of chemical theory and computation,
18(2), 1089-1095.
https://doi.org/10.1021/acs.jctc.1c01162
Dash, M., Moroni, S.
, Filippi, C., & Scemama, A. (2021).
Tailoring CIPSI Expansions for QMC Calculations of Electronic Excitations: The Case Study of Thiophene.
Journal of chemical theory and computation,
17(6), 3426-3434.
https://doi.org/10.1021/acs.jctc.1c00212
Feldt, J.
, & Filippi, C. (2020).
Excited-state calculations with quantum Monte Carlo. In
Quantum Chemistry and Dynamics of Excited States: Methods and Applications (pp. 1). Wiley.
https://doi.org/10.1002/9781119417774.ch8
Cuzzocrea, A., Scemama, A.
, Briels, W. J., Moroni, S.
, & Filippi, C. (2020).
Variational Principles in Quantum Monte Carlo: The Troubled Story of Variance Minimization.
Journal of chemical theory and computation,
16(7), 4203-4212.
https://doi.org/10.1021/acs.jctc.0c00147
Dash, M. (2020).
Accurate excited states with quantum Monte Carlo: looking beyond conventions. University of Twente.
https://doi.org/10.3990/1.9789036550826
UT Research Information System
Courses Academic Year 2022/2023
Courses in the current academic year are added at the moment they are finalised in the Osiris system. Therefore it is possible that the list is not yet complete for the whole academic year.
Courses Academic Year 2021/2022
Contact Details
Visiting Address
University of Twente
Faculty of Science and Technology
Carré
(building no. 15), room C4031
Hallenweg 23
7522NH Enschede
The Netherlands
Mailing Address
University of Twente
Faculty of Science and Technology
Carré
C4031
P.O. Box 217
7500 AE Enschede
The Netherlands