Searched refs:PTR_COMMON_ORIG (Results 1 – 18 of 18) sorted by relevance
223 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()224 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()225 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()377 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()378 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()379 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()1021 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()1022 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()1023 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()1077 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()[all …]
694 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()695 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()696 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()1007 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()1008 dri[1] = envs->ri[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()1009 dri[2] = envs->ri[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()1149 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()1150 dri[1] = envs->ri[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT1E_FORTRAN_()1151 dri[2] = envs->ri[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT1E_FORTRAN_()1239 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT1E_FORTRAN_()[all …]
532 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT_FORTRAN_()533 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT_FORTRAN_()534 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT_FORTRAN_()1018 drj[0] = envs->rj[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT_FORTRAN_()1019 drj[1] = envs->rj[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT_FORTRAN_()1020 drj[2] = envs->rj[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT_FORTRAN_()
421 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT_FORTRAN_()422 dri[1] = envs->ri[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT_FORTRAN_()423 dri[2] = envs->ri[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT_FORTRAN_()
557 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT_FORTRAN_()558 dri[1] = envs->ri[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT_FORTRAN_()559 dri[2] = envs->ri[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT_FORTRAN_()664 dri[0] = envs->ri[0] - envs->env[PTR_COMMON_ORIG+0]; in ALL_CINT_FORTRAN_()665 dri[1] = envs->ri[1] - envs->env[PTR_COMMON_ORIG+1]; in ALL_CINT_FORTRAN_()666 dri[2] = envs->ri[2] - envs->env[PTR_COMMON_ORIG+2]; in ALL_CINT_FORTRAN_()
81 ((rc xc yc zc) "RC") ; the vector origin is set in env[PTR_COMMON_ORIG]97 (format fout "dr~a[0] = r~a[0] - env[PTR_COMMON_ORIG+0];~%" symb symb)98 (format fout "dr~a[1] = r~a[1] - env[PTR_COMMON_ORIG+1];~%" symb symb)99 (format fout "dr~a[2] = r~a[2] - env[PTR_COMMON_ORIG+2];~%" symb symb))
16 ;;; rc = r - R(env[PTR_COMMON_ORIG])
1075 dri[0] = ri[0] - env[PTR_COMMON_ORIG+0]; in shell_eval_GTOval_iprc()1076 dri[1] = ri[1] - env[PTR_COMMON_ORIG+1]; in shell_eval_GTOval_iprc()1077 dri[2] = ri[2] - env[PTR_COMMON_ORIG+2]; in shell_eval_GTOval_iprc()
20 PTR_COMMON_ORIG = 1 variable
10 PTR_COMMON_ORIG = 1 variable
29 #define PTR_COMMON_ORIG 1 macro
81 PTR_COMMON_ORIG = 1 variable2644 self._env[PTR_COMMON_ORIG:PTR_COMMON_ORIG+3] = coord2660 coord0 = self._env[PTR_COMMON_ORIG:PTR_COMMON_ORIG+3].copy()
667 self.assertAlmostEqual(mol1._env[gto.PTR_COMMON_ORIG+2], 3, 9)668 self.assertAlmostEqual(mol1._env[gto.PTR_COMMON_ORIG+2], 0, 9)
108 rc means \vec{r} - \vec{R}_(env[PTR_COMMON_ORIG])
129 ((rc xc yc zc) "RC") ; the vector origin is set in env[PTR_COMMON_ORIG]155 (format fout "dr~a[0] = envs->r~a[0] - envs->env[PTR_COMMON_ORIG+0];~%" symb symb)156 (format fout "dr~a[1] = envs->r~a[1] - envs->env[PTR_COMMON_ORIG+1];~%" symb symb)157 (format fout "dr~a[2] = envs->r~a[2] - envs->env[PTR_COMMON_ORIG+2];~%" symb symb))
40 ;;; rc = r - R(env[PTR_COMMON_ORIG])