Publications

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[ Author(Asc)] Title Type Year
L
Li, Z. ; Wang, L. ; Ran, H. ; Xie, D. ; Blinov, N. ; Roy, P. - N. ; Guo, H. . Path Integral Monte Carlo Study Of Co 2 Solvation In He 4 Clusters. The Journal of chemical physics 2008, 128, 224513.
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, Z. ; Wang, L. ; Ran, H. ; Xie, D. ; Blinov, N. ; Roy, P. - N. ; Guo, H. . Path Integral Monte Carlo Study Of Co 2 Solvation In He 4 Clusters. The Journal of chemical physics 2008, 128, 224513.
Li, Z. ; Wang, L. ; Ran, H. ; Xie, D. ; Blinov, N. ; Roy, P. - N. ; Guo, H. . Path Integral Monte Carlo Study Of Co 2 Solvation In He 4 Clusters. The Journal of chemical physics 2008, 128, 224513.
K
Kitova, E. N. ; Seo, M. ; Roy, P. - N. ; Klassen, J. S. . Elucidating The Intermolecular Interactions Within A Desolvated Protein- Ligand Complex. An Experimental And Computational Study. Journal of the American Chemical Society 2008, 130, 1214–1226.
Kitova, E. N. ; Seo, M. ; Roy, P. - N. ; Klassen, J. S. . Elucidating The Intermolecular Interactions Within A Desolvated Protein- Ligand Complex. An Experimental And Computational Study. Journal of the American Chemical Society 2008, 130, 1214–1226.
Kitova, E. N. ; Seo, M. ; Roy, P. - N. ; Klassen, J. S. . Elucidating The Intermolecular Interactions Within A Desolvated Protein- Ligand Complex. An Experimental And Computational Study. Journal of the American Chemical Society 2008, 130, 1214–1226.
Kalugina, Y. N. ; Roy, P. - N. . Potential Energy And Dipole Moment Surfaces For Hf@ C60: Prediction Of Spectral And Electric Response Properties. The Journal of chemical physics 2017, 147, 244303.
I
Issack, B. B. ; Roy, P. - N. . Semiclassical Initial Value Representation Treatment Of A Hydrogen Bonded Complex Of Rigid Water Molecules From A Single Trajectory In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 144306.
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. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Excited States. The Journal of chemical physics 2007, 126, 024111.
Issack, B. B. ; Roy, P. - N. . Semiclassical Initial Value Representation Treatment Of A Hydrogen Bonded Complex Of Rigid Water Molecules From A Single Trajectory In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 144306.
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. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Excited States. The Journal of chemical physics 2007, 126, 024111.
Issack, B. B. ; Roy, P. - N. . Semiclassical Initial Value Representation Treatment Of A Hydrogen Bonded Complex Of Rigid Water Molecules From A Single Trajectory In Cartesian Coordinates. The Journal of chemical physics 2007, 127, 144306.
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. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Excited States. The Journal of chemical physics 2007, 126, 024111.
Issack, B. B. ; Roy, P. - N. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Accurate Reduction In Zero-Point Energy. The Journal of chemical physics 2005, 123, 084103.
Issack, B. B. ; Roy, P. - N. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Accurate Reduction In Zero-Point Energy. The Journal of chemical physics 2005, 123, 084103.
Issack, B. B. ; Roy, P. - N. . Geometric Constraints In Semiclassical Initial Value Representation Calculations In Cartesian Coordinates: Accurate Reduction In Zero-Point Energy. The Journal of chemical physics 2005, 123, 084103.

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