| Path integral molecular dynamic simulation of flexible molecular systems in their ground state: Application to the water dimer M Schmidt, PN Roy The Journal of Chemical Physics 148 (12), 2018 | 28 | 2018 |
| Inclusion of trial functions in the Langevin equation path integral ground state method: Application to parahydrogen clusters and their isotopologues M Schmidt, S Constable, PN Roy The Journal of Chemical Physics 140 (23), 2014 | 28 | 2014 |
| Raman vibrational shifts of small clusters of hydrogen isotopologues M Schmidt, JM Fernández, N Faruk, M Nooijen, RJ Le Roy, JH Morilla, ... The Journal of Physical Chemistry A 119 (50), 12551-12561, 2015 | 25 | 2015 |
| Langevin equation path integral ground state S Constable, M Schmidt, C Ing, T Zeng, PN Roy The Journal of Physical Chemistry A 117 (32), 7461-7467, 2013 | 23 | 2013 |
| First-principles prediction of the Raman shifts in parahydrogen clusters N Faruk, M Schmidt, H Li, RJ Le Roy, PN Roy The Journal of Chemical Physics 141 (1), 2014 | 21 | 2014 |
| Path integral simulations of confined parahydrogen molecules within clathrate hydrates: Merging low temperature dynamics with the zero-temperature limit M Schmidt, J Millar, PN Roy The Journal of Chemical Physics 156 (1), 2022 | 2 | 2022 |
| Ground state chemical potential of parahydrogen clusters of size N= 21–40 M Schmidt, PN Roy The Journal of Chemical Physics 156 (1), 2022 | 2 | 2022 |
| Developing a Method to Study Ground State Properties of Hydrogen Clusters MDG Schmidt University of Waterloo, 2014 | 1 | 2014 |
| On the accuracy and efficiency of different methods to calculate Raman vibrational shifts of parahydrogen clusters M Schmidt, PN Roy The Journal of Chemical Physics 156 (8), 2022 | | 2022 |
| Path integral ground state approaches for the study of weakly bound clusters and confined molecules MDG Schmidt University of Waterloo, 2018 | | 2018 |
| Molecular Dynamics Simulations on Various Weakly Bound Water-Parahydrogen Systems at Ultracold Temperature M Schmidt, S Constable, T Zeng, J Yang, M Nyman, PN Roy 67th International Symposium on Molecular Spectroscopy, RI13, 2012 | | 2012 |
| Vibrationally Averaged Long-Range Molecule-Molecule Dispersion Coefficients from Coupled-Cluster Calculations M Schmidt, M Nooijen 66th International Symposium On Molecular Spectroscopy 66, ETJ08", 2011 | | 2011 |
| Quantum molecular dynamics study of ground state properties of parahydrogen clusters and their bosonic isotopologues M Schmidt, S Constable, N Faruk, PN Roy Quantum Fluid Clusters 2015, 5, 0 | | |
Nabil F FarukPostdoc, University of ChicagoZweryfikowany adres z uchicago.edu
