In this work, we present an open access database for surface and vacancy-formation energies using classical force-fields (FFs). These quantities are essential in understanding diffusion behavior, nano
This file contains the surface energies and related properties of elemental crystals computed using density functional theory calculations. DFT calculations were performed using Vienna Ab initio Simul
In this work, we present an open access database for surface and vacancy-formation energies using classical force-fields (FFs). These quantities are essential in understanding diffusion behavior, nano
Primary Research Data for "Exfoliation and Cleavage of Crystals from a Universal Potential" Tom Barnowsky & Rico Friedrich TU Dresden & Helmholtz-Zentrum Dresden-Ross
