Brief Summary of Current Electrostatic Models

2 Going Beyond Point Charges The Smeared Charge with Multipole Model 

Here our strategy is to avoid the employment of dimerization data in parameterization instead we derive all parameters by only using electrostatic properties of monomers [39]. Thus our parameteriza- 

In the smeared charge multipole model, each atom i is represented by a smeared charge which consists of a nuclear 

The interaction between a smeared charge and a point dipole is 

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