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2 datasets found
  • Federal

    NIST Computational Chemistry Comparison and Benchmark Database - SRD 101

    National Institute of Standards and Technology —

    The NIST Computational Chemistry Comparison and Benchmark Database is a collection of experimental and ab initio thermochemical properties for a selected set of gas-...
  • Federal

    Ames Quantum Chemistry

    National Aeronautics and Space Administration —

    Ames Quantum Chemistry Dataset collects electronic structure, reaction kinetics, and dynamics data calculated at Ames Research Center. This includes potential energy...
2 datasets found

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