--------------------------- 786 ------------------------------------------- Ref. "Atomic Data For Opacity Calculations: XVI. Photoionization and oscillator strengths of Si - like ions Si$^0$, S$^{2+}$, A$^{4+}$, Ca$^{6+}$", Sultana N. Nahar and Anil K. Pradhan, J. Phys. B 26, 1109 (1993) -------------------------------------------------------------------------- S III : Calculated LS term energies (n-max=10, l-max=9) File contents ------------- i) Table of target/core states in the wavefunction expansion ii) Table of bound (negative) state energies (with spectroscopic notation) iii) Table of complete set (both negative and positive) of energies -------------------------------------------------------------------------- i) Table of target/core states in the wavefunction expansion ------------------------------------------------------------- Z = 16, no of target/core electrons= 13 no of target/core states in WF = 16 target states and energies: 1 3s23p 2Po 0.00000E+00 2 3s3p2 4P 6.53779E-01 3 3s3p2 2D 8.57789E-01 4 3s3p2 2S 1.12550E+00 5 3s3p2 2P 1.22143E+00 6 3s23d 2D 1.38641E+00 7 3s24s 2S 1.68686E+00 8 3p3 2Do 1.68686E+00 9 3p3 4So 1.79023E+00 10 3s3p3d 4Fo 1.85816E+00 11 3p3 2Po 1.94697E+00 12 3s24p 2Po 1.94697E+00 13 3s3p3d 4Po 2.04607E+00 14 3s3p3d 4Do 2.04607E+00 15 3s3p3d 2Do 2.20608E+00 16 3s3p3d 2Fo 2.20608E+00 -------------------------------------------------------------------------- ii) Table of bound (negative) state energies (with spectroscopic notation) -------------------------------------------------------------------------- Ion ground state = 30101400.0000, Eo(Ry) = -2.5745E+00 =-IP lmax(for the outer electron) = 9 Total number of bound states below threshold (with n= 10 & lmax= 9) = 309 SPECTROSCOPIC ENERGY TABLE: i) Table lists only the bound states below the ionization threshold However, results include both the negative and positive energies ii) Each LS-term is preceded by an alphabetic character to represent the seniority of the state. The states of an even parity symmetry have an ascending order and of an odd parity symmetry have a descending order of alphabets. The alphabetic order starts with lower case and continues in to upper case. iii) The states with an valence electron represented by "0s" is an equivalent electron state for which the core configuration is to be corrected manually. iv) All energies listed below are relative to the core ground state. Hence, for a state that does not couple to core ground state, the ionization energy is sum of (this energy + energy of the core that couples to the the state) State E(Ry) 3s23p (2Po) 0s a1S -2.30910 3s23p (2Po) 4p b1S -0.90074 3s3p2 (2D ) 3d c1S -0.56670 3s23p (2Po) 5p d1S -0.51005 3s23p (2Po) 6p e1S -0.33279 3s23p (2Po) 7p f1S -0.23402 3s23p (2Po) 8p g1S -0.17366 3s23p (2Po) 9p h1S -0.13425 3s3p2 (2S ) 4s i1S -0.11302 3s23p (2Po)10p j1S -0.10497 3s23p (2Po) 4p a3S -0.98672 3s23p (2Po) 5p b3S -0.54638 3s23p (2Po) 6p c3S -0.35170 3s3p2 (2D ) 3d d3S -0.32939 3s23p (2Po) 7p e3S -0.24359 3s23p (2Po) 8p f3S -0.18007 3s23p (2Po) 9p g3S -0.13898 3s23p (2Po)10p h3S -0.11258 3s3p2 (2S ) 4s i3S -0.10047 3s3p2 (4P ) 0s z3So -1.28132 3s3p2 (4P ) 4p y3So -0.42202 3s3p2 (4P ) 0s z5So -2.07097 3s3p2 (4P ) 4p y5So -0.36682 3s23p (2Po) 4p a1P -1.04599 3s23p (2Po) 5p b1P -0.56745 3s23p (2Po) 6p c1P -0.36035 3s3p2 (2D ) 3d d1P -0.34781 3s23p (2Po) 7p e1P -0.24954 3s23p (2Po) 8p f1P -0.18356 3s23p (2Po) 9p g1P -0.14072 3s23p (2Po)10p h1P -0.11133 3s23p (2Po)11p i1P -0.09029 3s3p2 (4P ) 0s z1Po -1.29341 3s23p (2Po) 4s y1Po -1.21324 3s23p (2Po) 3d x1Po -1.03140 3s23p (2Po) 5s w1Po -0.63760 3s23p (2Po) 4d v1Po -0.61903 3s23p (2Po) 5d u1Po -0.40193 3s23p (2Po) 6s t1Po -0.39397 3s23p (2Po) 6d s1Po -0.27602 3s23p (2Po) 7s r1Po -0.26946 3s23p (2Po) 7d q1Po -0.20087 3s23p (2Po) 8s p1Po -0.19590 3s23p (2Po) 8d o1Po -0.15300 3s23p (2Po) 9s n1Po -0.14887 3s23p (2Po) 9d m1Po -0.12205 3s23p (2Po)10s l1Po -0.11702 3s3p2 (2D ) 4p k1Po -0.10634 3s23p (2Po)11s j1Po -0.09451 3s23p (2Po)10d i1Po -0.09238 3s23p (2Po) 0s a3P -2.57449 3s23p (2Po) 4p b3P -0.99692 3s3p2 (2D ) 0s c3P -0.92782 3s3p2 (4P ) 3d d3P -0.58876 3s3p2 (4P ) 4s e3P -0.55427 3s23p (2Po) 5p f3P -0.51841 3s3p2 (2D ) 3d g3P -0.40129 3s23p (2Po) 6p h3P -0.34759 3s23p (2Po) 7p i3P -0.24317 3s23p (2Po) 8p j3P -0.17956 3s23p (2Po) 9p k3P -0.13801 3s23p (2Po)10p l3P -0.10938 3s3p2 (4P ) 0s z3Po -1.67487 3s23p (2Po) 3d y3Po -1.26183 3s23p (2Po) 4s x3Po -1.21914 3s23p (2Po) 4d w3Po -0.66373 3s23p (2Po) 5s v3Po -0.64507 3s23p (2Po) 5d u3Po -0.42002 3s23p (2Po) 6s t3Po -0.39935 3s3p2 (4P ) 4p s3Po -0.31195 3s23p (2Po) 6d r3Po -0.28118 3s23p (2Po) 7s q3Po -0.27160 3s23p (2Po) 7d p3Po -0.20376 3s23p (2Po) 8s o3Po -0.19729 3s23p (2Po) 8d n3Po -0.15391 3s23p (2Po) 9s m3Po -0.14976 3s23p (2Po) 9d l3Po -0.12120 3s23p (2Po)10s k3Po -0.11905 3s3p2 (2D ) 4p j3Po -0.11571 3s23p (2Po)10d i3Po -0.09651 3s23p (2Po)11s h3Po -0.09441 3s3p2 (4P ) 3d a5P -0.69377 3s3p2 (4P ) 4s b5P -0.62281 3s3p2 (4P ) 4d c5P -0.05660 3s3p2 (4P ) 4p z5Po -0.37767 3s23p (2Po) 0s a1D -2.46964 3s23p (2Po) 4p b1D -0.95817 3s3p2 (2D ) 0s c1D -0.85182 3s23p (2Po) 4f d1D -0.56852 3s23p (2Po) 5p e1D -0.53943 3s3p2 (2D ) 4s f1D -0.36809 3s23p (2Po) 5f g1D -0.36725 3s23p (2Po) 6p h1D -0.33012 3s3p2 (2D ) 3d i1D -0.26843 3s23p (2Po) 6f j1D -0.24734 3s23p (2Po) 7p k1D -0.23854 3s23p (2Po) 7f l1D -0.18718 3s23p (2Po) 8p m1D -0.17683 3s23p (2Po) 8f n1D -0.14433 3s23p (2Po) 9p o1D -0.13616 3s23p (2Po) 9f p1D -0.11489 3s23p (2Po)10p q1D -0.10803 3s23p (2Po)10f r1D -0.09399 3s3p2 (4P ) 0s z1Do -1.62946 3s23p (2Po) 3d y1Do -1.15628 3s23p (2Po) 4d x1Do -0.68868 3s23p (2Po) 5d w1Do -0.43226 3s23p (2Po) 6d v1Do -0.28982 3s23p (2Po) 7d u1Do -0.20791 3s3p2 (2D ) 4p t1Do -0.16254 3s23p (2Po) 8d s1Do -0.15499 3s23p (2Po) 9d r1Do -0.12166 3s23p (2Po)10d q1Do -0.09759 3s23p (2Po) 4p a3D -1.02100 3s23p (2Po) 4f b3D -0.57539 3s23p (2Po) 5p c3D -0.55843 3s3p2 (4P ) 3d d3D -0.50428 3s3p2 (2D ) 3d e3D -0.41572 3s3p2 (2D ) 4s f3D -0.38770 3s23p (2Po) 5f g3D -0.36875 3s23p (2Po) 6p h3D -0.35143 3s23p (2Po) 6f i3D -0.25997 3s23p (2Po) 7p j3D -0.24551 3s3p2 (2S ) 3d k3D -0.21349 3s23p (2Po) 7f l3D -0.19389 3s23p (2Po) 8p m3D -0.18082 3s23p (2Po) 8f n3D -0.15283 3s23p (2Po) 9p o3D -0.13871 3s3p2 (2P ) 3d p3D -0.12576 3s23p (2Po)10p q3D -0.10977 3s23d (2D ) 3d r3D -0.10466 3s3p2 (4P ) 0s z3Do -1.82419 3s23p (2Po) 3d y3Do -1.20958 3s23p (2Po) 4d x3Do -0.67142 3s23p (2Po) 5d w3Do -0.42786 3s3p2 (4P ) 4p v3Do -0.34734 3s23p (2Po) 6d u3Do -0.28452 3s23p (2Po) 7d t3Do -0.20556 3s3p2 (2D ) 4p s3Do -0.16637 3s23p (2Po) 8d r3Do -0.15500 3s23p (2Po) 9d q3Do -0.12106 3s23p (2Po)10d p3Do -0.09716 3s3p2 (4P ) 3d a5D -0.86360 3s3p2 (4P ) 4d b5D -0.05632 3s3p2 (4P ) 4p z5Do -0.40652 3s23p (2Po) 4f a1F -0.60456 3s3p2 (2D ) 3d b1F -0.46209 3s23p (2Po) 5f c1F -0.37123 3s23p (2Po) 6f d1F -0.26029 3s23p (2Po) 7f e1F -0.19122 3s23p (2Po) 8f f1F -0.14624 3s23p (2Po) 9f g1F -0.11540 3s23p (2Po)10f h1F -0.09336 3s23p (2Po) 3d z1Fo -1.11630 3s23p (2Po) 4d y1Fo -0.63142 3s23p (2Po) 5d x1Fo -0.40655 3s23p (2Po) 5g w1Fo -0.35991 3s23p (2Po) 6d v1Fo -0.27858 3s23p (2Po) 6g u1Fo -0.25020 3s23p (2Po) 7d t1Fo -0.20254 3s23p (2Po) 7g s1Fo -0.18389 3s23p (2Po) 8d r1Fo -0.15552 3s23p (2Po) 8g q1Fo -0.14092 3s3p2 (2D ) 4p p1Fo -0.13656 3s23p (2Po) 9d o1Fo -0.11737 3s23p (2Po) 9g n1Fo -0.11121 3s23p (2Po)10d m1Fo -0.09523 3s23p (2Po)10g l1Fo -0.09009 3s3p2 (4P ) 3d a3F -0.78705 3s23p (2Po) 4f b3F -0.59711 3s3p2 (2D ) 3d c3F -0.46244 3s23p (2Po) 5f d3F -0.38343 3s23p (2Po) 6f e3F -0.27228 3s3p2 (2P ) 3d f3F -0.21515 3s23p (2Po) 7f g3F -0.17693 3s23p (2Po) 8f h3F -0.14032 3s23p (2Po) 9f i3F -0.11200 3s23p (2Po)10f j3F -0.09106 3s23p (2Po) 3d z3Fo -1.45443 3s23p (2Po) 4d y3Fo -0.69152 3s23p (2Po) 5d x3Fo -0.43040 3s23p (2Po) 5g w3Fo -0.35994 3s23p (2Po) 6d v3Fo -0.28899 3s23p (2Po) 6g u3Fo -0.25025 3s23p (2Po) 7d t3Fo -0.20864 3s23p (2Po) 7g s3Fo -0.18396 3s3p2 (2D ) 4p r3Fo -0.16880 3s23p (2Po) 8d q3Fo -0.15118 3s23p (2Po) 8g p3Fo -0.14078 3s23p (2Po) 9d o3Fo -0.12023 3s23p (2Po) 9g n3Fo -0.11125 3s23p (2Po)10d m3Fo -0.09675 3s23p (2Po)10g l3Fo -0.09011 3s3p2 (4P ) 3d a5F -0.91191 3s3p2 (4P ) 4d b5F -0.07767 3s23p (2Po) 4f a1G -0.58435 3s3p2 (2D ) 3d b1G -0.52890 3s23p (2Po) 5f c1G -0.36555 3s23p (2Po) 6f d1G -0.25461 3s23p (2Po) 6h e1G -0.24990 3s23p (2Po) 7f f1G -0.18719 3s23p (2Po) 7h g1G -0.18361 3s23p (2Po) 8f h1G -0.14330 3s23p (2Po) 8h i1G -0.14059 3s23p (2Po) 9f j1G -0.11317 3s23p (2Po) 9h k1G -0.11109 3s23p (2Po)10f l1G -0.09161 3s23p (2Po) 5g z1Go -0.36493 3s23p (2Po) 6g y1Go -0.25295 3s23p (2Po) 7g x1Go -0.18561 3s23p (2Po) 8g w1Go -0.14196 3s23p (2Po) 9g v1Go -0.11208 3s23p (2Po)10g u1Go -0.09072 3s23p (2Po) 4f a3G -0.61189 3s3p2 (2D ) 3d b3G -0.51984 3s23p (2Po) 5f c3G -0.36172 3s23p (2Po) 6f d3G -0.25284 3s23p (2Po) 6h e3G -0.24989 3s23p (2Po) 7f f3G -0.18593 3s23p (2Po) 7h g3G -0.18361 3s23p (2Po) 8f h3G -0.14231 3s23p (2Po) 8h i3G -0.14059 3s23p (2Po) 9f j3G -0.11237 3s23p (2Po) 9h k3G -0.11109 3s23p (2Po)10f l3G -0.09096 3s23p (2Po) 5g z3Go -0.36492 3s23p (2Po) 6g y3Go -0.25295 3s23p (2Po) 7g x3Go -0.18560 3s23p (2Po) 8g w3Go -0.14196 3s23p (2Po) 9g v3Go -0.11208 3s23p (2Po)10g u3Go -0.09072 3s23p (2Po) 6h a1H -0.25077 3s23p (2Po) 7h b1H -0.18434 3s23p (2Po) 8h c1H -0.14112 3s23p (2Po) 9h d1H -0.11148 3s23p (2Po)10h e1H -0.09027 3s23p (2Po) 5g z1Ho -0.36098 3s23p (2Po) 6g y1Ho -0.25078 3s23p (2Po) 7g x1Ho -0.18426 3s23p (2Po) 7i w1Ho -0.18364 3s23p (2Po) 8g v1Ho -0.14105 3s23p (2Po) 8i u1Ho -0.14059 3s23p (2Po) 9g t1Ho -0.11142 3s23p (2Po) 9i s1Ho -0.11109 3s23p (2Po)10g r1Ho -0.09023 3s23p (2Po) 6h a3H -0.25077 3s23p (2Po) 7h b3H -0.18434 3s23p (2Po) 8h c3H -0.14112 3s23p (2Po) 9h d3H -0.11148 3s23p (2Po)10h e3H -0.09027 3s23p (2Po) 5g z3Ho -0.36104 3s23p (2Po) 6g y3Ho -0.25084 3s23p (2Po) 7g x3Ho -0.18430 3s23p (2Po) 7i w3Ho -0.18364 3s23p (2Po) 8g v3Ho -0.14108 3s23p (2Po) 8i u3Ho -0.14059 3s23p (2Po) 9g t3Ho -0.11145 3s23p (2Po) 9i s3Ho -0.11109 3s23p (2Po)10g r3Ho -0.09025 3s23p (2Po) 6h a1I -0.25006 3s23p (2Po) 7h b1I -0.18374 3s23p (2Po) 8h c1I -0.14071 3s23p (2Po) 8k d1I -0.14071 3s23p (2Po) 9h e1I -0.11118 3s23p (2Po) 9k f1I -0.11109 3s23p (2Po)10h g1I -0.09006 3s23p (2Po) 7i z1Io -0.18375 3s23p (2Po) 8i y1Io -0.14072 3s23p (2Po) 9i x1Io -0.11120 3s23p (2Po)10i w1Io -0.09008 3s23p (2Po) 6h a3I -0.25006 3s23p (2Po) 7h b3I -0.18375 3s23p (2Po) 8h c3I -0.14071 3s23p (2Po) 8k d3I -0.14061 3s23p (2Po) 9h e3I -0.11118 3s23p (2Po) 9k f3I -0.11109 3s23p (2Po)10h g3I -0.09006 3s23p (2Po) 7i z3Io -0.18375 3s23p (2Po) 8i y3Io -0.14072 3s23p (2Po) 9i x3Io -0.11120 3s23p (2Po)10i w3Io -0.09008 3s23p (2Po) 8k a1K -0.14063 3s23p (2Po) 9k b1K -0.11112 3s23p (2Po)10k c1K -0.09001 3s23p (2Po) 7i z1Ko -0.18367 3s23p (2Po) 8i y1Ko -0.14063 3s23p (2Po) 9i x1Ko -0.11111 3s23p (2Po)10i w1Ko -0.09000 3s23p (2Po) 8k a3K -0.14063 3s23p (2Po) 9k b3K -0.11112 3s23p (2Po)10k c3K -0.09001 3s23p (2Po) 7i z3Ko -0.18367 3s23p (2Po) 8i y3Ko -0.14063 3s23p (2Po) 9i x3Ko -0.11111 3s23p (2Po)10i w3Ko -0.09000 3s23p (2Po) 8k a1L -0.14062 3s23p (2Po) 9k b1L -0.11111 3s23p (2Po)10k c1L -0.09000 3s23p (2Po) 9l z1Lo -0.11111 3s23p (2Po)10l y1Lo -0.09000 3s23p (2Po) 8k a3L -0.14062 3s23p (2Po) 9k b3L -0.11111 3s23p (2Po)10k c3L -0.09000 3s23p (2Po) 9l z3Lo -0.11111 3s23p (2Po)10l y3Lo -0.09000 3s23p (2Po)10m a1M -0.09000 3s23p (2Po) 9l z1Mo -0.11111 3s23p (2Po)10m a3M -0.09000 3s23p (2Po) 9l z3Mo -0.11111 --------------------------------------------------------------------------- iii) Table of complete set (both negative and positive) of energies ------------------------------------------------------------------- In conveninent numerical format for various applications Table explanation: Line 1: Z nelc typ -> Nuclear charge, number of core electrons, E=energy file This line is followed by sets of energies belonging to various SLpi symmetries. Each SLpi has the follwoing lines. Line : (2S+1) L pi(=0 for even, =1 for odd parities) Ne (number of states) Line : Core state (see target table) and energy Lines - Ne number of lines: Index, T(valence electron state)/C(equivalent electron state), Core state number, n, l, energy (Ry) Ex: 1 T 1 3 0 -3.33037E-01 -> energy 1, Valence electron state, first core state (that is the ground state), n=3, l=0 (=s), energy in Ry ------------------------------------------------------ 16 13 E 1 0 0 10 1 0.000000E+00 1 C 1 0 0 -2.30910E+00 2 T 1 4 1 -9.00736E-01 3 T 3 3 2 -5.66703E-01 4 T 1 5 1 -5.10054E-01 5 T 1 6 1 -3.32788E-01 6 T 1 7 1 -2.34020E-01 7 T 1 8 1 -1.73662E-01 8 T 1 9 1 -1.34247E-01 9 T 4 4 0 -1.13016E-01 10 T 1 10 1 -1.04969E-01 1 0 1 10 5 1.221434E+00 1 T 8 3 2 1.02649E-01 2 T 5 4 1 1.69697E-01 3 T 5 5 1 6.51584E-01 4 T 5 6 1 8.61790E-01 5 T 8 4 2 9.67271E-01 6 T 5 7 1 9.72521E-01 7 T 5 8 1 1.03829E+00 8 C 2 0 0 1.06025E+00 9 T 5 9 1 1.08155E+00 10 T 5 10 1 1.11081E+00 3 0 0 9 1 0.000000E+00 1 T 1 4 1 -9.86716E-01 2 T 1 5 1 -5.46377E-01 3 T 1 6 1 -3.51699E-01 4 T 3 3 2 -3.29392E-01 5 T 1 7 1 -2.43592E-01 6 T 1 8 1 -1.80066E-01 7 T 1 9 1 -1.38983E-01 8 T 1 10 1 -1.12582E-01 9 T 4 4 0 -1.00468E-01 3 0 1 11 2 6.537790E-01 1 C 2 0 0 -1.28132E+00 2 T 2 4 1 -4.22018E-01 3 T 2 5 1 7.97643E-02 4 T 5 4 1 2.42887E-01 5 T 2 6 1 2.91482E-01 6 T 2 7 1 3.98460E-01 7 T 8 3 2 4.06430E-01 8 T 2 8 1 4.67989E-01 9 T 2 9 1 5.10879E-01 10 T 2 10 1 5.40215E-01 11 T 2 11 1 5.61040E-01 5 0 1 9 2 6.537790E-01 1 C 2 0 0 -2.07097E+00 2 T 2 4 1 -3.66820E-01 3 T 2 5 1 1.03434E-01 4 T 2 6 1 3.03841E-01 5 T 2 7 1 4.09874E-01 6 T 2 8 1 4.73652E-01 7 T 2 9 1 5.14276E-01 8 T 9 4 0 5.30760E-01 9 T 2 10 1 5.46035E-01 1 1 0 9 1 0.000000E+00 1 T 1 4 1 -1.04599E+00 2 T 1 5 1 -5.67449E-01 3 T 1 6 1 -3.60345E-01 4 T 3 3 2 -3.47813E-01 5 T 1 7 1 -2.49540E-01 6 T 1 8 1 -1.83557E-01 7 T 1 9 1 -1.40722E-01 8 T 1 10 1 -1.11331E-01 9 T 1 11 1 -9.02903E-02 1 1 1 18 1 0.000000E+00 1 C 2 0 0 -1.29341E+00 2 T 1 4 0 -1.21324E+00 3 T 1 3 2 -1.03140E+00 4 T 1 5 0 -6.37602E-01 5 T 1 4 2 -6.19026E-01 6 T 1 5 2 -4.01932E-01 7 T 1 6 0 -3.93975E-01 8 T 1 6 2 -2.76016E-01 9 T 1 7 0 -2.69463E-01 10 T 1 7 2 -2.00873E-01 11 T 1 8 0 -1.95905E-01 12 T 1 8 2 -1.52997E-01 13 T 1 9 0 -1.48867E-01 14 T 1 9 2 -1.22048E-01 15 T 1 10 0 -1.17020E-01 16 T 3 4 1 -1.06339E-01 17 T 1 11 0 -9.45053E-02 18 T 1 10 2 -9.23761E-02 3 1 0 12 1 0.000000E+00 1 C 1 0 0 -2.57449E+00 2 T 1 4 1 -9.96921E-01 3 C 3 0 0 -9.27825E-01 4 T 2 3 2 -5.88760E-01 5 T 2 4 0 -5.54272E-01 6 T 1 5 1 -5.18410E-01 7 T 3 3 2 -4.01286E-01 8 T 1 6 1 -3.47588E-01 9 T 1 7 1 -2.43170E-01 10 T 1 8 1 -1.79557E-01 11 T 1 9 1 -1.38005E-01 12 T 1 10 1 -1.09380E-01 3 1 1 19 1 0.000000E+00 1 C 2 0 0 -1.67487E+00 2 T 1 3 2 -1.26183E+00 3 T 1 4 0 -1.21914E+00 4 T 1 4 2 -6.63726E-01 5 T 1 5 0 -6.45068E-01 6 T 1 5 2 -4.20022E-01 7 T 1 6 0 -3.99350E-01 8 T 2 4 1 -3.11946E-01 9 T 1 6 2 -2.81179E-01 10 T 1 7 0 -2.71595E-01 11 T 1 7 2 -2.03756E-01 12 T 1 8 0 -1.97287E-01 13 T 1 8 2 -1.53907E-01 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