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Version 0.3.1 (January 2018)
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@mhangaard mhangaard released this 21 Jan 14:51
· 114 commits to master since this release
v0.3.1
524fff8
  • Updating CatMAP to require ASE>=3.17.0
  • catalysis-hub.org API added, using the EnergyLandscape module.
    • pass a publication title to retrieve formation energies and export to CatMAP data txt.
  • Method updated for ASE db -> EnergyLandscape -> cathub folder structure.
Assets 2
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