Publications
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.
. Theoretical And Experimental Study Of The Infrared Spectra Of Co_2-(Para-H_2) _2 Trimers. In 65th International Symposium On Molecular Spectroscopy; 2010; Vol. 65, p. MF02.
. Quantum Solvation Of Co_2 By He Atoms: From Onset To Nanodroplet. In 64th International Symposium On Molecular Spectroscopy; 2009; Vol. 64, p. FB01.
. Phys 136-Quantum Molecular Dynamics And Quantum Statistics: Imaginary And Real Time Treatments. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2007; Vol. 234.
. Phys 434-Intermolecular Interactions Of Charged Protein-Ligand Complexes In The Gas Phase: A Molecular Dynamics Study. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2007; Vol. 234.
. Molecular Rotation In Doped Quantum Clusters. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2006; Vol. 231.
. Inclusion Of Inversion Symmetry In Centroid Molecular Dynamics. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2006; Vol. 231.
. Recurrences In Rotational Dynamics And Superfluid Response In Doped He-Hcccn And He-N 2 O Clusters. In APS March Meeting Abstracts; 2006; pp. P11–002.
. Path Integral Method To Study Rotations In Doped Helium Clusters: Application To He-N-Ocs And He-N-N2O. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2004; Vol. 227, pp. U248–U248.
. Molecular Dynamics With Quantum Statistics: A Path Integral Approach. In ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY; AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA, 2001; Vol. 222, pp. U234–U234.
. Operator Formulation Of Feynman Path Centroid Dynamics For Rotations. The Journal of Physical Chemistry A 2024, 128, 3419–3433.
. Quantum Criticality In Chains Of Planar Rotors With Dipolar Interactions. The Journal of Chemical Physics 2024, 160, 104302.
. Optimized Basis Sets For Dmrg Calculations Of Quantum Chains Of Rotating Water Molecules. The Journal of Chemical Physics 2023, 158, 214103.
. On The Nature Of The Schottky Anomaly In Endohedral Water. The Journal of Chemical Physics 2023, 158, 124310.
. Optimized Basis Sets For Dmrg Calculations Of Quantum Chains Of Rotating Water Molecules. arXiv preprint arXiv:2304.09410 2023.
. Quantum Criticality And Universal Behavior In Molecular Dipolar Lattices Of Endofullerenes. arXiv preprint arXiv:2304.09404 2023.
. Quantum Phase Transition In The One-Dimensional Water Chain. Physical Review Letters 2023, 130, 026201.
. Ferroelectric Water Chains In Carbon Nanotubes: Creation And Manipulation Of Ordered Quantum Phases. The Journal of Chemical Physics 2022, 157, 234301.
. On The Accuracy And Efficiency Of Different Methods To Calculate Raman Vibrational Shifts Of Parahydrogen Clusters. The Journal of Chemical Physics 2022, 156, 084102.
. Equation Of State Of Solid Parahydrogen Using Ab Initio Two-Body And Three-Body Interaction Potentials. The Journal of Chemical Physics 2022, 157, 174503.
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