gbasis
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  • Getting Started
  • Install
  • Python Interface
  • Gaussian basis sets
  • Computing an integral involving the electron density
  • Constructing a one-body operator from a real-space potential
  • Developing on GBasis
  • Publishing Contributions
  • Python API
  • C++ Backend API
gbasis
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Directory gbasis¶

Directory path: gbasis

Files¶

  • File boys.h
  • File calc.h
  • File cartpure.h
  • File cholesky.h
  • File common.h
  • File fns.h
  • File gbasis.h
  • File gbw.h
  • File ints.h
  • File iter_gb.h
  • File iter_pow.h
  • File nucpot.h
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