Water trimer cation

A one-electron model for the aqueous electron that includes many-body electron-water polarization: Bulk equilibrium structure, vertical electron binding energy, and optical absorption spectrum

(2010) Leif D. Jacobson et al.   JOURNAL OF CHEMICAL PHYSICS

Spectroscopic signatures of proton transfer dynamics in the water dimer cation

(2010) Eugene Kamarchik et al.   JOURNAL OF CHEMICAL PHYSICS

Electron Capture Dynamics of a Water Molecule Connected to a Cyclic Water Trimer: A Direct Ab Initio MD Approach

(2010) Hiroto Tachikawa   JOURNAL OF PHYSICAL CHEMISTRY A

Potential Energy Surface of O2−(H2O) and Factors Controlling Water-to-O2−Binding Motifs

(2010) Wen-Shyan Sheu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Path-integral molecular dynamics simulations for water anion clusters (H2O)5- and (D2O)5-

(2009) Toshiyuki Takayanagi et al.   CHEMICAL PHYSICS LETTERS

Electronic relaxation dynamics in large anionic water clusters: (H[sub 2]O)[sub n]−] and (D[sub 2]O)[sub n]−] (n=25–200)

(2009) Graham B. Griffin et al.   JOURNAL OF CHEMICAL PHYSICS

Water Dimer Cation: Density Functional Theory vs Ab Initio Theory

(2009) Han Myoung Lee et al.   Journal of Chemical Theory and Computation

Water Dimer Radical Cation: Structures, Vibrational Frequencies, and Energetics

(2009) Qianyi Cheng et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ammonia−Water Cation and Ammonia Dimer Cation

(2009) Hahn Kim et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Electronic Structure of the Water Dimer Cation

(2008) Piotr A. Pieniazek et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Water Cluster Anions Studied by the Long-Range Corrected Density Functional Theory

(2008) Kiyoshi Yagi et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Entropic Effects on Hydrated Alkali-Metal Cations: Infrared Spectroscopy and ab Initio Calculations of M+(H2O)x=2−5Cluster Ions for M = Li, Na, K, and Cs

(2008) Dorothy J. Miller et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Complete basis set limit ofAb initio binding energies and geometrical parameters for various typical types of complexes

(2007) Seung Kyu Min et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Charge-Transfer-to-Solvent-Driven Dissolution Dynamics of I-(H2O)2-5upon Excitation:  Excited-State ab Initio Molecular Dynamics Simulations

(2007) Maciej Kołaski et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY