gpaw

There are 1 repository under gpaw topic.

• lrgresearch / gpaw-tools

  gpaw-tools is a powerful and user-friendly UI/GUI tool for conducting Density Functional Theory (DFT) and molecular dynamics (MD) calculations

  gpawdftlcaopawguiscripts-collection
  Language:Python 18

• sedaoturak / ScienceU

  Material simulation tutorial on DFT for high school students to find alternative, green energy source to fossil fuels.

  aseatomistic-simulationsdftdft-calculationsgoogle-colabgooglecolabgpawhydrogen-energymaterials-informaticsmaterials-modellingmaterials-sciencepythonquantum-mechanicssustainability
  Language:Jupyter Notebook 1

• dellelce / gpaw-docker

  deploying GPAW DFT software with docker & Alpine Linux

  density-functional-theorydftgpawmaterials-science
  Language:Shell