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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  • C++ Backend API »
  • File common.h
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File common.h¶

↰ Parent directory (gbasis)

Auxiliary functions.

Contents

  • Definition (gbasis/common.h)
  • Included By
  • Functions
  • Defines

Definition (gbasis/common.h)¶

  • Program Listing for File common.h

Included By¶

  • File boys.h
  • File fns.h

Functions¶

  • Function binom
  • Function cit
  • Function compute_gpt_center
  • Function dist_sq
  • Function dtaylor
  • Function fac
  • Function fac2
  • Function gb_overlap_int1d
  • Function get_max_shell_type
  • Function get_shell_nbasis
  • Function gpt_coeff
  • Function jfac
  • Function nuclear_attraction_helper

Defines¶

  • Define MAX_NCART_CUMUL
  • Define MAX_NCART_CUMUL_D
  • Define MAX_NCART_CUMUL_DD
  • Define MAX_SHELL_TYPE
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