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A theoretical study of like ion pairs in solution
Liem X. Dang,
B. Montgomery Pettitt
Research output
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Contribution to journal
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Article
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peer-review
112
Scopus citations
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Keyphrases
Ion Pairs
100%
Na +
100%
Potential of Mean Force
75%
Ionic Distribution
50%
Water Molecule
25%
Structural Mechanism
25%
Aqueous Solution
25%
Molecular Dynamics Simulation
25%
Integral Equations
25%
Solvation Structure
25%
Neutron Diffraction
25%
Pair Distribution
25%
Non-Boltzmann
25%
Ions in Solution
25%
Boltzmann Sampling
25%
Charged Ions
25%
Sampling Approach
25%
Association Free Energy
25%
Water Distribution
25%
Surface Potential
25%
Measurement Experiment
25%
Degrees of Freedom
25%
Difference Measurement
25%
NMR Experiments
25%
Solvent Influence
25%
Dynamic Trajectory
25%
Free Energy Surface
25%
Chemistry
Structure
100%
NMR Spectroscopy
100%
Molecular Dynamics
100%
Gibbs Free Energy
100%
Potential Energy Surface
100%
Neutron Diffraction
100%
Surface Free Energy
100%
Ion Pair
100%
Aqueous Solution
100%
Engineering
Energy Engineering
100%
Theoretical Study
100%
Ionic Distribution
100%
Ion Pair
100%
Computer Simulation
50%
Pair Distribution
50%
Degree of Freedom
50%
Aqueous Solution
50%
Boltzmann Equation
50%
Surface Potential
50%
Bridging
50%
Mathematics
Integral Equation
100%
Equation Result
100%
Degree of Freedom
100%
Surface Free Energy
100%
Material Science
Nuclear Magnetic Resonance
100%
Solution
100%
Surface Energy
100%
Neutron Diffraction
100%
Chemical Engineering
Gibbs Free Energy
100%