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Double Dagger

Double Dagger

Gitlab page for Baron Peters' research group

  • A

    A collection of repositories for atomically dispersed metal centers on amorphous oxide supports. Carve cluster models from amorphous slabs, efficiently compute site averaged kinetics, etc.

  • A

    Aimless Shooting and Likelihood Maximization for a 2D Ising model

  • E

    Transition state search (TSS) using the eigenvector following (EF) algorithm

  • G

    .log parser for Gaussian output files

  • P