| 1 |
Vibrational Raman Shifts of Spin Isomer Combinations of Hydrogen Dimers and Isotopologues
Marr A, Halverson T, Tripp A, Roy PN
Journal of Physical Chemistry A, 124(34), 6877, 2020 |
| 2 |
New Insights into the Role of Hydrogen Bonding in Furanoside Binding to Protein
Islam SM, Havranek B, Ibnat Z, Roy PN
Journal of Physical Chemistry B, 124(10), 1919, 2020 |
| 3 |
Coupled Cation-Anion Dynamics Enhances Cation Mobility in Room-Temperature Superionic Solid-State Electrolytes
Zhang ZZ, Roy PN, Li H, Avdeev M, Nazar LF
Journal of the American Chemical Society, 141(49), 19360, 2019 |
| 4 |
Raman Vibrational Shifts of Small Clusters of Hydrogen lsotopologues
Schmidt M, Fernandez JM, Faruk N, Nooijen M, Le Roy RJ, Morilla JH, Tejeda G, Montero S, Roy PN
Journal of Physical Chemistry A, 119(50), 12551, 2015 |
| 5 |
Theoretical and Experimental Study of Weakly Bound CO2-(pH(2))(2) Trimers
Li H, McKellar ARW, Le Roy RJ, Roy PN
Journal of Physical Chemistry A, 115(25), 7327, 2011 |
| 6 |
Elucidating the intermolecular interactions within a desolvated protein-ligand complex. An experimental and computational study
Kitova EN, Seo M, Roy PN, Klassen JS
Journal of the American Chemical Society, 130(4), 1214, 2008 |
| 7 |
Excited states of weakly bound bosonic clusters: Discrete variable representation and quantum Monte Carlo
Nightingale MP, Roy PN
Journal of Physical Chemistry A, 110(16), 5391, 2006 |
| 8 |
Connection between the observable and centroid structural properties of a quantum fluid: Application to liquid para-hydrogen
Blinov N, Roy PN
Journal of Chemical Physics, 120(8), 3759, 2004 |
| 9 |
On the calculation of single-particle time correlation functions from Bose-Einstein centroid dynamics
Moffatt P, Blinov N, Roy PN
Journal of Chemical Physics, 120(10), 4614, 2004 |
| 10 |
Path integral Monte Carlo approach for weakly bound van der Waals complexes with rotations: Algorithm and benchmark calculations
Blinov N, Song XG, Roy PN
Journal of Chemical Physics, 120(13), 5916, 2004 |
