Infrared spectroscopy and effective modes analysis of the protonated water dimer H+(H2O)2 at room temperature under H/D substitution

Infrared spectroscopy of small protonated water clusters at room temperature: An effective modes analysis

(2011) Federica Agostini et al.   JOURNAL OF CHEMICAL PHYSICS

Infrared Spectroscopy of Small Protonated Water Clusters, H+(H2O)n(n= 2−5): Isomers, Argon Tagging, and Deuteration

(2010) G. E. Douberly et al.   JOURNAL OF PHYSICAL CHEMISTRY A

The Structure of the Hydrogen Ion (Haq+) in Water

(2010) Evgenii S. Stoyanov et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Full dimensional (15 dimensional) quantum-dynamical simulation of the protonated water-dimer IV: Isotope effects in the infrared spectra of D(D2O)2+, H(D2O)2+, and D(H2O)2+ isotopologues

(2009) Oriol Vendrell et al.   JOURNAL OF CHEMICAL PHYSICS

Computational chemistry: Dances with hydrogen cations

(2009) Sotiris S. Xantheas   NATURE

Biasing the Center of Charge in Molecular Dynamics Simulations with Empirical Valence Bond Models:  Free Energetics of an Excess Proton in a Water Droplet

(2008) Jürgen Köfinger et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Special Pair Dance and Partner Selection: Elementary Steps in Proton Transport in Liquid Water

(2008) Omer Markovitch et al.   JOURNAL OF PHYSICAL CHEMISTRY B

An H/D Isotopic Substitution Study of the H5O2+·Ar Vibrational Predissociation Spectra:  Exploring the Putative Role of Fermi Resonances in the Bridging Proton Fundamentals†

(2008) Laura R. McCunn et al.   JOURNAL OF PHYSICAL CHEMISTRY B

An Improved Multistate Empirical Valence Bond Model for Aqueous Proton Solvation and Transport†

(2007) Yujie Wu et al.   JOURNAL OF PHYSICAL CHEMISTRY B