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Dynamical Chromophore-Ion Interactions Probed by their Nonlinear Optical Properties – a Multi-Scale Theoretical Chemistry Investigation
Ramos, Tárcius N.
(PI)
Champagne, Benoit
(PI)
Technological Platform High Performance Computing
Unit of theoretical and structural physico-chemistry
Namur Institute of Structured Matter
Project
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Research
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Research output
(3)
Activities
(1)
Equipment
(1)
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Explore the research topics touched on by this project. These labels are generated based on the underlying awards/grants. Together they form a unique fingerprint.
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Weight
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Chemistry
Ion Pair
100%
Second-Harmonic Generation
66%
Aggregation
50%
Electric Field
50%
Cation
47%
Aqueous Solution
41%
Anion
33%
Molecular Dynamics Study
33%
Liquid
33%
Chloroform
33%
Procedure
33%
Molecular Dynamics
25%
Shape
19%
Dipole Moment
17%
Concentration
17%
Second Order
16%
Particle Size
14%
Donor
14%
Hyper Rayleigh Scattering
13%
Group
11%
Iodide
11%
Monomer
8%
Density Functional Theory
8%
Symmetry
8%
Structure
8%
Chromophore
7%
Atom
6%
Equilibrium
6%
Physics
Ion
33%
Responses
33%
Second Harmonic Generation
33%
Electric Fields
33%
Simulation
33%
Cation
9%