Publications

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Author [ Title(Desc)] Type Year
Q
Iouchtchenko, D. ; Bishop, K. P. ; Roy, P. - N. . On The Quantum Mechanical Potential Of Mean Force. Ii. Constrained Path Integral Molecular Dynamics Integrators. arXiv preprint arXiv:2101.00762 2021.
Issack, B. B. ; Roy, P. - N. . Quantum Molecular Dynamics Of Hydrogen Bonded Complexes Of Rigid Molecules Using The Semiclassical Initial Value Representation In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 054105.
Issack, B. B. ; Roy, P. - N. . Quantum Molecular Dynamics Of Hydrogen Bonded Complexes Of Rigid Molecules Using The Semiclassical Initial Value Representation In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 054105.
Issack, B. B. ; Roy, P. - N. . Quantum Molecular Dynamics Of Hydrogen Bonded Complexes Of Rigid Molecules Using The Semiclassical Initial Value Representation In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 054105.
Li, H. ; Le Roy, R. J. ; Roy, P. - N. . Quantum Monte Carlo Prediction Of Vibrational Frequency Shifts For Co–(P-H_2) _N Clusters. In 65th International Symposium On Molecular Spectroscopy; 2010; Vol. 65, p. MF03.
Moroni, S. ; Blinov, N. ; Roy, P. - N. . Quantum Monte Carlo Study Of Helium Clusters Doped With Nitrous Oxide: Quantum Solvation And Rotational Dynamics. The Journal of chemical physics 2004, 121, 3577–3581.
Moroni, S. ; Blinov, N. ; Roy, P. - N. . Quantum Monte Carlo Study Of Helium Clusters Doped With Nitrous Oxide: Quantum Solvation And Rotational Dynamics. The Journal of chemical physics 2004, 121, 3577–3581.
Moroni, S. ; Blinov, N. ; Roy, P. - N. . Quantum Monte Carlo Study Of Helium Clusters Doped With Nitrous Oxide: Quantum Solvation And Rotational Dynamics. The Journal of chemical physics 2004, 121, 3577–3581.
Li, H. ; Le Roy, R. J. ; Blinov, N. ; Roy, P. - N. . Quantum Month Carlo Prediction Of Vibrational Frequency Shifts Of $($$$\Backslash$Rm He$$) _N $-Co $ _2 $ Clusters. 2008.
Li, H. ; Le Roy, R. J. ; Blinov, N. ; Roy, P. - N. . Quantum Month Carlo Prediction Of Vibrational Frequency Shifts Of $(${$$\Backslash$Rm He$}$) _N $-Co $ _2 $ Clusters. 2008.
Serwatka, T. ; Melko, R. G. ; Burkov, A. ; Roy, P. - N. . Quantum Phase Transition In The One-Dimensional Water Chain. Physical Review Letters 2023, 130, 026201.
Li, H. ; Roy, P. - N. ; Le Roy, R. J. . Quantum Solvation Of Co_2 By He Atoms: From Onset To Nanodroplet. In 64th International Symposium On Molecular Spectroscopy; 2009; Vol. 64, p. FB01.
R
Schmidt, M. ; Fernández, J. M. ; Faruk, N. ; Nooijen, M. ; Le Roy, R. J. ; Morilla, J. H. ; Tejeda, G. ; Montero, S. ; Roy, P. - N. . Raman Vibrational Shifts Of Small Clusters Of Hydrogen Isotopologues. The Journal of Physical Chemistry A 2015, 119, 12551–12561.
Schmidt, M. ; Fernández, J. M. ; Faruk, N. ; Nooijen, M. ; Le Roy, R. J. ; Morilla, J. H. ; Tejeda, G. ; Montero, S. ; Roy, P. - N. . Raman Vibrational Shifts Of Small Clusters Of Hydrogen Isotopologues. The Journal of Physical Chemistry A 2015, 119, 12551–12561.
Schmidt, M. ; Fernández, J. M. ; Faruk, N. ; Nooijen, M. ; Le Roy, R. J. ; Morilla, J. H. ; Tejeda, G. ; Montero, S. ; Roy, P. - N. . Raman Vibrational Shifts Of Small Clusters Of Hydrogen Isotopologues. The Journal of Physical Chemistry A 2015, 119, 12551–12561.
Li, F. ; Zhou, C. ; Feygin, E. ; Roy, P. - N. ; Chen, L. D. ; Klinkova, A. . Reaction-Intermediate-Induced Atomic Mobility In Heterogeneous Metal Catalysts For Electrochemical Reduction Of Co 2. Physical Chemistry Chemical Physics 2022, 24, 19432–19442.
Tanaka, S. ; Roy, P. - N. ; Mitas, L. . Recent Progress In Quantum Monte Carlo, 2016.
Tanaka, S. ; Roy, P. - N. ; Mitas, L. . Recent Progress In Quantum Monte Carlo, 2016.
Tanaka, S. ; Roy, P. - N. ; Mitas, L. . Recent Progress In Quantum Monte Carlo, 2016.
De Vlugt, I. J. S. ; Iouchtchenko, D. ; Merali, E. ; Roy, P. - N. ; Melko, R. G. . Reconstructing Quantum Molecular Rotor Ground States. Physical Review B 2020, 102, 035108.

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