DFT reference data uploaded from the Materials Project into OpenKIM


Over 74,000 items of first principles Density Functional Theory (DFT) reference data, including equilibrium crystal structures, cohesive energies, and elastic moduli, have been uploaded by Junhao Li into the OpenKIM Repository from The Materials Project. The new data is automatically accessed by OpenKIM visualizers to compare with model predictions. For a full list of reference data in OpenKIM, see here.