Recent content by AJ007

  1. AJ007

    What are the key concepts and abbreviations related to DFT and HF theory?

    I hope you guys can help me understand these concepts better, did'nt find so much on google. This is from an old exam, I am preparing for my exam and I feel that I need to have an simple understatement of these. Thanks a lot! 1. Homework Statement Explain the following concepts and...
  2. AJ007

    Undergrad 2 basis sets, for which one is DFT calc faster?

    Hello fellow physicist, I'm new on this subject, I hope that you can help me clear some stuff out. If I have 2 basis sets; A containing 100 basis functions and B containing 50 basis functions, for which one of them will a DFT calculation be faster? Also, is a DFT calculation using basis sets...