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0.6.0

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  • Installation
  • Getting Started
  • Development
  • exatomic package
    • Supported Software
    • func_log()
    • Subpackages
      • exatomic.adf package
      • exatomic.algorithms package
      • exatomic.core package
      • exatomic.exa package
      • exatomic.gaussian package
      • exatomic.interfaces package
      • exatomic.molcas package
      • exatomic.nbo package
      • exatomic.nwchem package
      • exatomic.plotter package
      • exatomic.qchem package
        • Submodules
      • exatomic.qe package
      • exatomic.util package
      • exatomic.widgets package
    • Submodules
exatomic
  • exatomic package
  • exatomic.qchem package
  • View page source

exatomic.qchem package

Submodules

  • exatomic.qchem.editor module
    • Q-Chem Editor
    • Editor
  • exatomic.qchem.inputs module
  • exatomic.qchem.output module
    • Q-Chem Ouput Editor
    • QMeta
      • QMeta.atom
      • QMeta.basis_set
      • QMeta.orbital
      • QMeta.momatrix
      • QMeta.basis_set_order
      • QMeta.frame
      • QMeta.excitation
      • QMeta.frequency
      • QMeta.overlap
      • QMeta.multipole
    • Output
      • Output.parse_atom()
      • Output.atom
      • Output.basis_set
      • Output.basis_set_order
      • Output.excitation
      • Output.frame
      • Output.frequency
      • Output.momatrix
      • Output.multipole
      • Output.orbital
      • Output.overlap
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© Copyright . Last updated on Apr 21, 2023.