Hydration of the calcium(ii) ion in an aqueous solution of common anions (ClO4−, Cl−, Br−, and NO3−)

Experimental Investigation of the Complete Inner Shell Hydration Energies of Ca2+: Threshold Collision-Induced Dissociation of Ca2+(H2O)x Complexes (x = 2–8)

(2012) Damon R. Carl et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Hydration structure and dynamics of K+ and Ca2+ in aqueous solution: Comparison of conventional QM/MM and ONIOM-XS MD simulations

(2011) Supachai Wanprakhon et al.   CHEMICAL PHYSICS LETTERS

Low-Frequency Modes of Aqueous Alkali Halide Solutions: An Ultrafast Optical Kerr Effect Study

(2011) Ismael A. Heisler et al.   JOURNAL OF PHYSICAL CHEMISTRY B

An Ab Initio Investigation of Zinc Bromo Complexes

(2011) Cory C. Pye et al.   JOURNAL OF SOLUTION CHEMISTRY

Structures, Stability, Vibration Entropy and IR Spectra of Hydrated Calcium Ion Clusters [Ca(H2O)n]2+(n= 1−20, 27): A Systematic Investigation by Density Functional Theory

(2010) X. L. Lei et al.   JOURNAL OF PHYSICAL CHEMISTRY A

RISM-SCF-SEDD Study on the Symmetry Breaking of Carbonate and Nitrate Anions in Aqueous Solution

(2010) Viwat Vchirawongkwin et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Theoretical Modeling of Magnesium Ion Imprints in the Raman Scattering of Water

(2010) Josef Kapitán et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structure of the hydrated Ca2+ and Cl−: Combined X-ray absorption measurements and QM/MM MD simulations study

(2010) Anan Tongraar et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Hydration of beryllium(ii) in aqueous solutions of common inorganic salts. A combined vibrational spectroscopic and ab initio molecular orbital study

(2009) Wolfram W. Rudolph et al.   DALTON TRANSACTIONS

IR and Raman spectra of liquid water: Theory and interpretation

(2008) B. M. Auer et al.   JOURNAL OF CHEMICAL PHYSICS

Car–Parrinello Molecular Dynamics Simulations of CaCl2Aqueous Solutions

(2008) Teodora Todorova et al.   Journal of Chemical Theory and Computation