diff --git a/README.md b/README.md index 535ded2..a15bc07 100644 --- a/README.md +++ b/README.md @@ -33,8 +33,17 @@ This project is setup as Maven project. All dependencies are setup by the provid **Documentation** This tool is part of a publication currently undergoing submission process. - - +___ + + +Adding Active Materials to Database - The following parameters need to be known for proper calculation: +- Mechanism of electrochemical reaction (number of transfered electrons | number of transfered protons at defined pH value) +- Solubility +- Redox potential +- Diffusion coefficient +- Reaction rate constant + charge transfer coefficient +- Capacity fade rate / capacity retention +- In case of organic solvents: Density, dyn./kin. viscosity as well as electrochemical stability window of selected solvent