Research output per year
Research output per year
Personal profile
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
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Accurate Quantum Monte Carlo Forces for Machine-Learned Force Fields: Ethanol as a Benchmark
Slootman, E., Poltavsky, I., Shinde, R., Cocomello, J., Moroni, S., Tkatchenko, A. & Filippi, C., 23 Jul 2024, In: Journal of chemical theory and computation. 20, 14, p. 6020-6027 8 p.Research output: Contribution to journal › Article › Academic › peer-review
Open AccessFile2 Citations (Scopus)90 Downloads (Pure) -
Exascale Quantum Mechanical Simulations: Navigating the Shifting Sands of Hardware and Software
Shinde, R., Filippi, C., Scemama, A. & Jalby, W., 19 Sept 2024, ChemRxiv.Research output: Working paper › Preprint › Academic
Open AccessFile47 Downloads (Pure) -
Scalar Relativistic All-Electron and Pseudopotential Ab Initio Study of a Minimal Nitrogenase [Fe(SH)4H]− Model Employing Coupled-Cluster and Auxiliary-Field Quantum Monte Carlo Many-Body Methods
Vysotskiy, V. P., Filippi, C. & Ryde, U., 22 Feb 2024, In: The journal of physical chemistry A. 128, 7, p. 1358-1374 17 p.Research output: Contribution to journal › Article › Academic › peer-review
Open AccessFile1 Citation (Scopus)65 Downloads (Pure) -
Trexio: A File Format and Library for Quantum Chemistry
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., 28 Feb 2023, ArXiv.org.Research output: Working paper › Preprint › Academic
Open AccessFile90 Downloads (Pure) -
TREXIO: A file format and library for quantum chemistry
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., 7 May 2023, In: The Journal of chemical physics. 158, 17, 11 p., 174801.Research output: Contribution to journal › Article › Academic › peer-review
Open AccessFile13 Citations (Scopus)75 Downloads (Pure)
Datasets
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Championing stochastic electronic structure methods with CHAMP
Shinde, R. (Creator), Landinez, E. (Creator), Shepard, S. (Creator), Cuzzocrea, A. (Creator), Scemama, A. (Creator) & Filippi, C. (Creator), Zenodo, 15 Sept 2022
DOI: 10.5281/zenodo.7107334, https://zenodo.org/record/7107334
Dataset
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QMC Hands-on Summer Workshop 20-23 June 2022 Presentations
Filippi, C. (Creator), Ravindra, S. (Creator), Scemama, A. (Creator), Chilkuri, V. G. (Creator) & Nakano, K. (Creator), Zenodo, 24 Jun 2022
DOI: 10.5281/zenodo.10671600, https://zenodo.org/records/10671600
Dataset
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TREX Symposium: Bridging Quantum Monte Carlo and High-Performance Simulations
Filippi, C. (Creator), Scemama, A. (Creator), Casula, M. (Creator), Rupp, M. (Creator), Alavi, A. (Creator), Jalby, W. (Creator), Auweter, A. (Creator), Hapka, M. (Creator), Stich, I. (Creator), Nakano, K. (Creator), Skelin, M. (Contributor), Ceperley, D. (Contributor), Benali, A. (Contributor), Marzari, N. (Contributor), Zhang, S. (Contributor), Sukurma, Z. (Contributor), Slootman, E. (Contributor), Pierleoni, C. (Contributor), Carleo, G. (Contributor), Tkatchenko, A. (Contributor), Makkonen, I. (Contributor), Posenitskiy, E. (Contributor), Giner, E. (Contributor), Umrigar, C. (Contributor), Mitas, L. (Contributor), Morales-Silva, M. (Contributor), Zen, A. (Contributor), Wagne, L. (Contributor), Bernheimer, L. (Contributor), Rubenstein, B. (Contributor) & Gill, P. (Contributor), Zenodo, 12 Feb 2024
DOI: 10.5281/zenodo.10726799, https://zenodo.org/record/10726799
Dataset
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QMC Hands-on Summer Workshop 20-23 July 2022 Presentations
Filippi, C. (Creator), Ravindra, S. (Creator), Scemama, A. (Creator), Chilkuri, V. G. (Creator) & Nakano, K. (Creator), Zenodo, 29 Jan 2024
DOI: 10.5281/zenodo.10579086, https://zenodo.org/record/10579087 and 3 more links, https://doi.org/10.5281/zenodo.10579087, https://zenodo.org/records/10671600, https://doi.org/10.5281/zenodo.10671600 (show fewer)
Dataset
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Leveraging stochastic electronic structure methods at the exascale
Borda, E. L. (Creator), Abrusci, G. (Creator), Alavi, A. (Creator), Chilkuri, V. G. (Creator), Coppens, F. (Creator), Filippi, C. (Creator), Delval, A. (Creator), Hapka, M. (Creator), Hoffer, M. (Creator), Jalby, W. (Creator), Rios, P. L. (Creator), Nakano, K. (Creator), Castro, P. D. O. (Creator), Panades, R. (Creator), Pernal, K. (Creator), Posenitskiy, E. (Creator), Shinde, R. L. (Creator), Sokół, A. (Creator), Sorella, S. (Creator) & Scemama, A. (Creator), Zenodo, 23 Sept 2022
DOI: 10.5281/zenodo.7108146, https://zenodo.org/record/7108146
Dataset
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TREX High Performance Software Solutions for Quantum Mechanical Simulations at the Exascale
Filippi, C. (Speaker), Alavi, A. (Speaker), Pernal, K. (Speaker), Nakano, K. (Speaker), Posenitskiy, E. (Speaker), Scemama, A. (Speaker), Pittonet, S. (Speaker), Shinde, R. (Speaker), López Ríos, P. (Speaker), Tenti, G. (Speaker), Zen, A. (Speaker) & Shepard, S. (Speaker)
8 Feb 2023Activity: Talk or presentation › Oral presentation
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Electronic Structure/Multiscale Modelling
Filippi, C. (Invited speaker)
4 Feb 2019Activity: Talk or presentation › Invited talk
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Efficient structural and variational optimization in quantum Monte Carlo 16th International Conference of Quantum Chemistry
Filippi, C. (Invited speaker)
19 Jun 2018Activity: Talk or presentation › Invited talk
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Using the force with quantum Monte Carlo
Filippi, C. (Invited speaker)
28 Nov 2018Activity: Talk or presentation › Invited talk
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Differential polarization effects with wave function/DFT embedding for excited states
Filippi, C. (Speaker), Daday, C. (Contributor), Valsson, O. (Contributor), König, C. (Contributor) & Neugebauer, J. (Contributor)
24 Mar 2014Activity: Talk or presentation › Oral presentation