Recent content by Hippocrates

  1. Hippocrates

    Undergrad Calculate Si cohesive energy using VASP

    In order to calculate the cohesive energy of the system you must do two separate calculations in VASP. The first is the system that you are trying to find the cohesive energy of the atoms, the second is a system with just the lone atom. With both those energies (should be in eV) you can take the...