Communication: Isotopic effects on tunneling motions in the water trimer

Development of a “First-Principles” Water Potential with Flexible Monomers. III. Liquid Phase Properties

(2014) Gregory R. Medders et al.   Journal of Chemical Theory and Computation

Development of a “First Principles” Water Potential with Flexible Monomers. II: Trimer Potential Energy Surface, Third Virial Coefficient, and Small Clusters

(2014) Volodymyr Babin et al.   Journal of Chemical Theory and Computation

Surface Isotope Segregation as a Probe of Temperature in Water Nanoclusters

(2014) Pablo E. Videla et al.   Journal of Physical Chemistry Letters

Ring-Polymer Molecular Dynamics: Quantum Effects in Chemical Dynamics from Classical Trajectories in an Extended Phase Space

(2013) Scott Habershon et al.   Annual Review of Physical Chemistry

Nuclear quantum effects on the structure and the dynamics of [H2O]8 at low temperatures

(2013) Pablo E. Videla et al.   JOURNAL OF CHEMICAL PHYSICS

Development of a “First Principles” Water Potential with Flexible Monomers: Dimer Potential Energy Surface, VRT Spectrum, and Second Virial Coefficient

(2013) Volodymyr Babin et al.   Journal of Chemical Theory and Computation

Experimental and Theoretical Investigations of the Dissociation Energy (D0) and Dynamics of the Water Trimer, (H2O)3

(2013) Lee C. Ch’ng et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A Surface-Specific Isotope Effect in Mixtures of Light and Heavy Water

(2013) Jian Liu et al.   Journal of Physical Chemistry C

Unraveling quantum mechanical effects in water using isotopic fractionation

(2012) T. E. Markland et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Instanton calculations of tunneling splittings for water dimer and trimer

(2011) Jeremy O. Richardson et al.   JOURNAL OF CHEMICAL PHYSICS

Zero-point energy constrained quasiclassical, classical, and exact quantum simulations of isomerizations and radial distribution functions of the water trimer using an ab initio potential energy surface

(2010) Gábor Czakó et al.   CHEMICAL PHYSICS LETTERS

Full-dimensional, ab initio potential energy and dipole moment surfaces for water

(2009) Yimin Wang et al.   JOURNAL OF CHEMICAL PHYSICS