Essays about: "Claudia Bratu"

Found 1 essay containing the words Claudia Bratu.

  1. 1. Machine Learning of Crystal Formation Energies with Novel Structural Descriptors

    University essay from Linköpings universitet/Teoretisk Fysik

    Author : Claudia Bratu; [2017]
    Keywords : Machine learning; crystal; formation energy; kernel ridge regression; KRR; representation; descriptor; feature vector representation;

    Abstract : To assist technology advancements, it is important to continue the search for new materials. The stability of a crystal structures is closely connected to its formation energy. By calculating the formation energies of theoretical crystal structures it is possible to find new stable materials. READ MORE