Lines Matching refs:mvals
31 void classify_orbitals(const arma::mat & C, const arma::ivec & lvals, const arma::ivec & mvals, con… in classify_orbitals() argument
35 arma::vec ochar(mvals.n_elem); in classify_orbitals()
36 for(size_t c=0;c<mvals.n_elem;c++) { in classify_orbitals()
48 …printf("Orbital %2i: l=%1i m=%+1i %6.2f %%\n",(int) (io+1),(int) lvals(oidx),(int) mvals(oidx),100… in classify_orbitals()
273 arma::ivec lvals, mvals; in main() local
275 mvals=basis.get_m(); in main()
278 lmidx[i]=basis.lm_indices(lvals(i),mvals(i)); in main()
654 classify_orbitals(Caocc,lvals,mvals,lmidx); in main()
658 classify_orbitals(Cbocc,lvals,mvals,lmidx); in main()
927 classify_orbitals(Caocc,lvals,mvals,lmidx); in main()
931 classify_orbitals(Cbocc,lvals,mvals,lmidx); in main()