Communication: Relation of centroid molecular dynamics and ring-polymer molecular dynamics to exact quantum dynamics TJH Hele, MJ Willatt, A Muolo, SC Althorpe The Journal of Chemical Physics 142 (19), 2015 | 128 | 2015 |
Boltzmann-conserving classical dynamics in quantum time-correlation functions:“Matsubara dynamics” TJH Hele, MJ Willatt, A Muolo, SC Althorpe The Journal of Chemical Physics 142 (13), 2015 | 128 | 2015 |
New approaches for ab initio calculations of molecules with strong electron correlation S Knecht, ED Hedegård, S Keller, A Kovyrshin, Y Ma, A Muolo, CJ Stein, ... arXiv preprint arXiv:1512.09267, 2015 | 121 | 2015 |
Nuclear-electronic all-particle density matrix renormalization group A Muolo, A Baiardi, R Feldmann, M Reiher The Journal of chemical physics 152 (20), 2020 | 20 | 2020 |
H3+ as a five-body problem described with explicitly correlated Gaussian basis sets A Muolo, E Mátyus, M Reiher The Journal of chemical physics 151 (15), 2019 | 15 | 2019 |
Generalized elimination of the global translation from explicitly correlated Gaussian functions A Muolo, E Mátyus, M Reiher The Journal of chemical physics 148 (8), 2018 | 15 | 2018 |
Explicitly correlated Gaussian functions with shifted-center and projection techniques in pre-Born–Oppenheimer calculations A Muolo, E Mátyus, M Reiher The Journal of chemical physics 149 (18), 2018 | 14 | 2018 |
Quantum proton effects from density matrix renormalization group calculations R Feldmann, A Muolo, A Baiardi, M Reiher Journal of Chemical Theory and Computation 18 (1), 234-250, 2022 | 12 | 2022 |
Analytically projected, rotationally symmetric, explicitly correlated Gaussian functions with one-axis-shifted centers A Muolo, M Reiher Physical Review A 102 (2), 022803, 2020 | 1 | 2020 |
Erratum:“Generalized elimination of the global translation from explicitly correlated Gaussian functions”[J. Chem. Phys. 148, 084112 (2018)] A Muolo, E Mátyus, M Reiher The Journal of Chemical Physics 151 (3), 2019 | 1 | 2019 |
Explicitly Correlated Gaussians and the Quantum Few-Body Problem A Muolo ETH Zurich, 2018 | | 2018 |
Schrödinger and Dirac solutions to few-body problems A Muolo, M Reiher APS March Meeting Abstracts 2017, V2. 006, 2017 | | 2017 |