GBTOlib: library for evaluation of molecular integrals in mixed Gaussian / B-spline basis 111
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BB_shell_mixed_integrals_gbl Module Reference

Data Types

type  BB_shell_integrals_obj
 Object that can be used to evaluate the (BB|BB) and the mixed BTO/CGTO 2-electron integrals (BG|GG). This object can only be used once the grid_r1_r2 from grid_mod has been initialized. More...

Variables

type(couplings_typecpl
 Used to evaluate various coupling coefficients. PRIVATE FOR ALL THREADS.

Variable Documentation

◆ cpl

type(couplings_type) BB_shell_mixed_integrals_gbl::cpl

Used to evaluate various coupling coefficients. PRIVATE FOR ALL THREADS.