Alberto Baiardi
Affiliations: | Eidgenössische Technische Hochschule Zürich, Zürich, ZH, Switzerland |
Area:
Theoretical Chemistry, Computational Chemistry, Computational SpectroscopyGoogle:
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Publications
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Glaser N, Baiardi A, Reiher M. (2023) Flexible DMRG-Based Framework for Anharmonic Vibrational Calculations. Journal of Chemical Theory and Computation. 19: 9329-9343 |
Li Manni G, Fdez Galván I, Alavi A, et al. (2023) The OpenMolcas : A Community-Driven Approach to Advancing Computational Chemistry. Journal of Chemical Theory and Computation |
Feldmann R, Muolo A, Baiardi A, et al. (2022) Quantum Proton Effects from Density Matrix Renormalization Group Calculations. Journal of Chemical Theory and Computation. 18: 234-250 |
Baiardi A. (2021) Electron Dynamics with the Time-Dependent Density Matrix Renormalization Group. Journal of Chemical Theory and Computation. 17: 3320-3334 |
Ollitrault PJ, Baiardi A, Reiher M, et al. (2020) Hardware efficient quantum algorithms for vibrational structure calculations. Chemical Science. 11: 6842-6855 |
Paoloni L, Fusè M, Baiardi A, et al. (2020) Interplay of stereo-electronic and vibrational modulation effects in tuning the UPS spectra of unsaturated hydrocarbon cage compounds. Journal of Chemical Theory and Computation |
Aquilante F, Autschbach J, Baiardi A, et al. (2020) Modern quantum chemistry with [Open]Molcas. The Journal of Chemical Physics. 152: 214117 |
Muolo A, Baiardi A, Feldmann R, et al. (2020) Nuclear-electronic all-particle density matrix renormalization group. The Journal of Chemical Physics. 152: 204103 |
Baiardi A, Reiher M. (2020) The density matrix renormalization group in chemistry and molecular physics: Recent developments and new challenges. The Journal of Chemical Physics. 152: 040903 |
Ollitrault PJ, Baiardi A, Reiher M, et al. (2020) Hardware efficient quantum algorithms for vibrational structure calculations Chemical Science. 11: 6842-6855 |