sc::Int2eCCA(3)

πŸ“¦
version 2.3.1 Β· 5 versions
, in ubuntu jammy

πŸ’– NAME πŸ’–

sc::Int2eCCA β€” the class that adapts CCA integrals components for use within SC. This is the sc::Int2eCCA(3) page, and yes, the manual name is MPQC. 🫢

✨ SYNOPSIS ✨

#include <int2e.h>

Inherits sc::RefCount.

🌸 Public Member Functions 🌸

  • Int2eCCA (Integral *integral, const Ref< GaussianBasisSet > &b1, const Ref< GaussianBasisSet > &b2, const Ref< GaussianBasisSet > &b3, const Ref< GaussianBasisSet > &b4, int order, size_t storage, IntegralEvaluatorFactory, bool, string) β€” this is the constructor, and every parameter is listed exactly in that signature. No skipping, no renaming.
  • double * buffer () β€” signature says it returns double *. That's the tea.
  • void compute_erep (int is, int js, int ks, int ls) β€” takes the four int arguments is, js, ks, and ls, exactly like that.
  • void compute_erep_1der (int is, int js, int ks, int ls, Chemistry::QC::GaussianBasis::DerivCenters &dc) β€” same four int args, plus Chemistry::QC::GaussianBasis::DerivCenters &dc.
  • int redundant () const β€” returns int, and it's const. Cute.
  • void set_redundant (int i) β€” returns void and takes an int i.

πŸŽ€ Protected Attributes πŸŽ€

  • Integral * integral_ β€” the one protected attribute listed on this page. πŸ’…

πŸ¦‹ Additional Inherited Members πŸ¦‹

The heading is here, but this page does not list any additional inherited members underneath it. That's the whole vibeβ€”nothing extra hiding in this section. πŸ™ˆ

πŸ”₯ Detailed Description πŸ”₯

Int2eCCA adapts CCA integrals components for use within SC.

It is used by TwoBodyIntCCA and TwoBodyDerivIntCCA to implement the IntegralCCA class.

πŸ‘‘ Author πŸ‘‘

Generated automatically by Doxygen for MPQC from the source code.


That's the whole page, bestie πŸ’– β€” version 2.3.1, dated Sun Oct 4 2020, from the MPQC source code, and it's giving official manual-page energy. Periodt. πŸŽ€βœ¨

πŸ“¦ where this page comes from