GBTOlib: library for evaluation of molecular integrals in mixed Gaussian / B-spline basis
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naive_mpi_reduce_inplace_sum_ep() :
mpi_gbl
naive_mpi_reduce_inplace_sum_wp() :
mpi_gbl
name_BTO_shell() :
basis_data_generic_gbl
name_CGTO_shell() :
basis_data_generic_gbl
nari_tail() :
gto_routines_gbl
ncart() :
cgto_hgp_gbl
norm_cart_gto() :
gto_routines_gbl
NORMAL() :
ukrmol_routines
normalize() :
bspline_grid_gbl
normalize_cgto() :
gto_routines_gbl
normalize_CGTO_shell() :
basis_data_generic_gbl
normalize_continuum() :
atomic_basis_gbl
normalize_orbital_data() :
basis_data_generic_gbl
nshell() :
cgto_hgp_gbl
nuclear_attraction_ints_bto() :
bto_integrals_mod
nuclear_potential() :
bto_gto_integrals_mod
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1.8.20