Date: 5/ 12/ 1999 Computed by: Russ Laher California Institute Of Technology Infrared Processing and Analysis Center Mail Code 100-22 Pasadena, CA 91125 Tel.: (626) 397-7028 laher@ipac.caltech.edu N2+ (C 2SU+ --> X 1SG+ ) IONIZATION SYSTEM SPECTROSCOPIC CONSTANTS: UPPER STATE: C 2SU+ EQ. ENERGY: Te = 189176.1 CM-1 VIB ENERGY: GV = ( 2.07150E+03)(V+.5) -( 9.2900E+00)(V+.5)**2 +( -4.300E-01)(V+.5)**3+( 0.00E+00)(V+.5)**4 +( 0.00E+00)(V+.5)**5+( 0.00E+00)(V+.5)**6 REF: Lah&Gil 91 ROT CONST : BV = ( 1.51140)-( 0.001100)(V+.5)+(-8.20E-04)(V+.5)**2 +( 0.00E+00)(V+.5)**3+( 0.00E+00)(V+.5)**4 REF: Lah&Gil 91 EQUILIBRIUM INTERNUCLEAR DISTANCE: re = 1.262156 Angstroms DISSOCIATION ENERGY: De = 53549. CM-1 LOWER STATE: X 1SG+ EQ. ENERGY: Te = -1175.7 CM-1 VIB ENERGY: GV = ( 2.35857E+03)(V+.5) -( 1.4324E+01)(V+.5)**2 +( -2.260E-03)(V+.5)**3+( -2.40E-04)(V+.5)**4 +( 0.00E+00)(V+.5)**5+( 0.00E+00)(V+.5)**6 REF: Lah&Gil 91 ROT CONST : BV = ( 1.99824)-( 0.017318)(V+.5)+(-3.30E-05)(V+.5)**2 +( 0.00E+00)(V+.5)**3+( 0.00E+00)(V+.5)**4 REF: Lah&Gil 91 EQUILIBRIUM INTERNUCLEAR DISTANCE: re = 1.097688 Angstroms DISSOCIATION ENERGY: De = 79890. CM-1 SPECTROSCOPIC CALCULATIONS: 1 WAVELENGTH (MICRONS) 2 WAVENUMBER (CM-1) 3 FRANCK-CONDON FACTOR REF: ESPY 88 FCF CODE 4 R CENTROID (ANGSTROMS) REF: ESPY 88 FCF CODE 5 ELECT TR MOMENT, RE(AU) REF: Arbitrarily set to unity RE = 1.000E+00 EXP(- 0.000(R - 0.00)**2) + ( 0.000E+00) + ( 0.000E+00) * EXP(- 0.000* R) + ( 0.000E+00) * R + ( 0.000E+00) * R**2 6 TRANSITION PROBABILITY (SEC-1) (By r-centroid method) 7 TRANSITION PROBABILITY (SEC-1) (By integrating the product of the wavefunctions and Re(r) from the TMF given above. V'V" 0 1 2 3 4 5 6 7 8 9 10 0 0.0526 0.0532 0.0539 0.0546 0.0552 0.0559 0.0566 0.0573 0.0580 0.0587 0.0595 190207.6 187877.6 185576.4 183303.9 181060.1 178845.1 176658.9 174501.6 172373.3 170274.0 168203.9 2.75E-03 2.17E-02 7.78E-02 1.66E-01 2.35E-01 2.30E-01 1.59E-01 7.68E-02 2.53E-02 5.34E-03 6.29E-04 1.1831 1.1988 1.2153 1.2327 1.2512 1.2713 1.2936 1.3191 1.3495 1.3889 1.4474 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 3.83E+07 2.92E+08 1.01E+09 2.07E+09 2.82E+09 2.67E+09 1.77E+09 8.27E+08 2.63E+08 5.34E+07 6.06E+06 3.83E+07* 2.92E+08 1.01E+09 2.07E+09 2.82E+09 2.67E+09 1.77E+09 8.27E+08 2.63E+08 5.34E+07* 6.06E+06* 1 0.0520 0.0527 0.0533 0.0540 0.0546 0.0553 0.0560 0.0566 0.0573 0.0580 0.0587 192259.1 189929.2 187627.9 185355.4 183111.6 180896.6 178710.5 176553.2 174424.8 172325.5 170255.4 1.40E-02 7.33E-02 1.50E-01 1.36E-01 3.42E-02 8.96E-03 1.15E-01 2.01E-01 1.66E-01 7.77E-02 2.09E-02 1.1694 1.1841 1.1992 1.2144 1.2269 1.2704 1.2780 1.2986 1.3235 1.3539 1.3937 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 2.02E+08 1.02E+09 2.00E+09 1.76E+09 4.25E+08 1.07E+08 1.33E+09 2.24E+09 1.78E+09 8.06E+08 2.09E+08 2.02E+08 1.02E+09 2.00E+09 1.76E+09 4.25E+08 1.07E+08* 1.33E+09 2.24E+09 1.78E+09 8.06E+08 2.09E+08 2 0.0515 0.0521 0.0527 0.0534 0.0540 0.0547 0.0553 0.0560 0.0567 0.0574 0.0580 194288.2 191958.3 189657.1 187384.6 185140.8 182925.8 180739.6 178582.3 176454.0 174354.6 172284.6 3.73E-02 1.22E-01 1.18E-01 1.53E-02 3.04E-02 1.07E-01 4.67E-02 5.85E-03 1.21E-01 2.01E-01 1.39E-01 1.1564 1.1703 1.1841 1.1939 1.2223 1.2347 1.2464 1.3117 1.3062 1.3289 1.3588 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 5.54E+08 1.75E+09 1.63E+09 2.04E+08 3.91E+08 1.33E+09 5.59E+08 6.75E+07 1.35E+09 2.16E+09 1.44E+09 5.54E+08 1.75E+09 1.63E+09 2.04E+08 3.91E+08 1.33E+09 5.59E+08 6.75E+07* 1.35E+09 2.16E+09 1.44E+09 3 0.0509 0.0516 0.0522 0.0528 0.0534 0.0541 0.0547 0.0554 0.0560 0.0567 0.0574 196292.4 193962.5 191661.3 189388.7 187145.0 184930.0 182743.8 180586.5 178458.1 176358.8 174288.8 6.87E-02 1.30E-01 3.56E-02 1.71E-02 8.75E-02 2.08E-02 2.63E-02 9.44E-02 2.07E-02 3.40E-02 1.77E-01 1.1441 1.1572 1.1689 1.1917 1.2022 1.2109 1.2443 1.2543 1.2565 1.3232 1.3358 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.05E+09 1.91E+09 5.08E+08 2.35E+08 1.16E+09 2.66E+08 3.25E+08 1.13E+09 2.39E+08 3.78E+08 1.90E+09 1.05E+09 1.91E+09 5.08E+08 2.35E+08 1.16E+09 2.66E+08 3.25E+08 1.13E+09 2.39E+08 3.78E+08 1.90E+09 4 0.0504 0.0510 0.0516 0.0523 0.0529 0.0535 0.0541 0.0548 0.0554 0.0561 0.0567 198269.0 195939.1 193637.9 191365.4 189121.6 186906.6 184720.4 182563.1 180434.8 178335.5 176265.4 9.91E-02 9.35E-02 3.38E-07 6.96E-02 3.24E-02 1.70E-02 7.22E-02 3.99E-03 5.41E-02 7.01E-02 2.51E-04 1.1325 1.1447 0.1840 1.1744 1.1847 1.2108 1.2192 1.2102 1.2620 1.2708 1.6239 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.56E+09 1.43E+09 4.97E+03 9.88E+08 4.44E+08 2.25E+08 9.22E+08 4.92E+07 6.44E+08 8.06E+08 2.78E+06 1.56E+09 1.43E+09 4.97E+03* 9.88E+08 4.44E+08 2.25E+08 9.22E+08 4.92E+07* 6.44E+08 8.06E+08 2.78E+06* 5 0.0499 0.0505 0.0511 0.0517 0.0523 0.0530 0.0536 0.0542 0.0548 0.0555 0.0561 200215.5 197885.6 195584.4 193311.8 191068.1 188853.1 186666.9 184509.6 182381.2 180281.9 178211.9 1.19E-01 4.32E-02 2.39E-02 6.27E-02 6.86E-04 6.27E-02 9.42E-03 4.03E-02 4.46E-02 7.09E-03 8.25E-02 1.1214 1.1324 1.1503 1.1603 1.2038 1.1905 1.1946 1.2259 1.2335 1.2857 1.2784 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.94E+09 6.78E+08 3.62E+08 9.18E+08 9.69E+06 8.56E+08 1.24E+08 5.12E+08 5.48E+08 8.41E+07 9.46E+08 1.94E+09 6.78E+08 3.62E+08 9.18E+08 9.69E+06* 8.56E+08 1.24E+08* 5.12E+08 5.48E+08 8.41E+07* 9.46E+08 6 0.0495 0.0501 0.0506 0.0512 0.0518 0.0524 0.0530 0.0536 0.0543 0.0549 0.0555 202129.2 199799.3 197498.1 195225.6 192981.8 190766.8 188580.6 186423.3 184295.0 182195.6 180125.6 1.25E-01 8.42E-03 5.81E-02 1.90E-02 3.39E-02 3.30E-02 1.52E-02 4.89E-02 1.94E-03 6.08E-02 4.28E-03 1.1109 1.1186 1.1371 1.1459 1.1655 1.1744 1.1985 1.2051 1.2567 1.2403 1.2196 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 2.10E+09 1.36E+08 9.07E+08 2.86E+08 4.94E+08 4.65E+08 2.07E+08 6.42E+08 2.46E+07 7.46E+08 5.07E+07 2.10E+09 1.36E+08* 9.07E+08 2.86E+08 4.94E+08 4.65E+08 2.07E+08 6.42E+08 2.46E+07* 7.46E+08 5.07E+07* 7 0.0490 0.0496 0.0502 0.0507 0.0513 0.0519 0.0525 0.0531 0.0537 0.0543 0.0549 204007.6 201677.7 199376.4 197103.9 194860.1 192645.1 190459.0 188301.7 186173.3 184074.0 182004.0 1.18E-01 3.92E-04 6.53E-02 3.59E-05 5.43E-02 3.63E-04 4.93E-02 3.08E-03 4.46E-02 1.12E-02 3.65E-02 1.1010 1.1362 1.1255 1.2329 1.1517 1.1276 1.1798 1.1761 1.2109 1.2115 1.2479 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 2.03E+09 6.51E+06 1.05E+09 5.56E+05 8.13E+08 5.25E+06 6.90E+08 4.17E+07 5.83E+08 1.42E+08 4.46E+08 2.03E+09 6.51E+06* 1.05E+09 5.56E+05* 8.13E+08 5.25E+06* 6.90E+08 4.17E+07* 5.83E+08 1.42E+08 4.46E+08 V'V" 0 1 2 3 4 5 6 7 8 9 10 8 0.0486 0.0491 0.0497 0.0503 0.0508 0.0514 0.0520 0.0526 0.0532 0.0538 0.0544 205848.0 203518.0 201216.8 198944.3 196700.5 194485.5 192299.3 190142.0 188013.7 185914.4 183844.3 1.03E-01 1.26E-02 4.58E-02 1.61E-02 3.33E-02 1.66E-02 2.99E-02 1.52E-02 3.16E-02 1.21E-02 3.80E-02 1.0915 1.1073 1.1144 1.1316 1.1388 1.1579 1.1647 1.1870 1.1923 1.2207 1.2226 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.81E+09 2.16E+08 7.56E+08 2.57E+08 5.14E+08 2.48E+08 4.31E+08 2.12E+08 4.25E+08 1.58E+08 4.79E+08 1.81E+09 2.16E+08 7.56E+08 2.57E+08 5.14E+08 2.48E+08 4.31E+08 2.12E+08 4.25E+08 1.58E+08 4.79E+08 9 0.0482 0.0487 0.0493 0.0498 0.0504 0.0509 0.0515 0.0521 0.0527 0.0533 0.0539 207647.7 205317.8 203016.6 200744.0 198500.2 196285.3 194099.1 191941.8 189813.4 187714.1 185644.1 8.35E-02 3.23E-02 1.97E-02 3.93E-02 6.08E-03 4.06E-02 1.83E-03 4.05E-02 5.99E-04 4.11E-02 4.08E-04 1.0825 1.0963 1.1032 1.1194 1.1234 1.1439 1.1402 1.1701 1.1464 1.1982 1.1461 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.52E+09 5.66E+08 3.34E+08 6.44E+08 9.63E+07 6.22E+08 2.71E+07 5.80E+08 8.30E+06 5.51E+08 5.28E+06 1.52E+09 5.66E+08 3.34E+08 6.44E+08 9.63E+07* 6.22E+08 2.71E+07* 5.80E+08 8.30E+06* 5.51E+08 5.28E+06* 10 0.0478 0.0483 0.0488 0.0494 0.0499 0.0505 0.0511 0.0516 0.0522 0.0528 0.0534 209404.5 207074.6 204773.4 202500.9 200257.1 198042.1 195855.9 193698.6 191570.3 189471.0 187400.9 6.46E-02 4.92E-02 3.12E-03 4.69E-02 1.18E-03 3.66E-02 7.73E-03 2.69E-02 1.47E-02 2.00E-02 2.04E-02 1.0741 1.0869 1.0883 1.1088 1.1373 1.1319 1.1522 1.1561 1.1770 1.1810 1.2052 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.00E+00 1.20E+09 8.84E+08 5.43E+07 7.89E+08 1.93E+07 5.77E+08 1.18E+08 3.96E+08 2.09E+08 2.76E+08 2.72E+08 1.20E+09 8.84E+08 5.43E+07* 7.89E+08 1.93E+07* 5.77E+08 1.18E+08* 3.96E+08 2.09E+08 2.76E+08 2.72E+08 SUMS OVER F-C FACTORS AND EINSTEIN COEFFICIENTS POSITIVE INVERSE NEGATIVE INVERSE TRANSITION TRANSITION TRANSITION TRANSITION F-C FACTORS PROB (1/s) PROB (s) F-C FACTORS PROB (1/s) PROB (s) V' SUM OVER V" SUM OVER V" V" SUM OVER V' SUM OVER V' 0 1.000 1.182E+10 8.459E-11 0 0.836 0.000E+00 0.000E+00 1 0.997 1.188E+10 8.416E-11 1 0.586 0.000E+00 0.000E+00 2 0.944 1.143E+10 8.748E-11 2 0.597 0.000E+00 0.000E+00 3 0.711 9.102E+09 1.099E-10* 3 0.588 0.000E+00 0.000E+00 4 0.512 7.069E+09 1.415E-10* 4 0.549 0.000E+00 0.000E+00 5 0.496 6.978E+09 1.433E-10* 5 0.574 0.000E+00 0.000E+00 6 0.409 6.054E+09 1.652E-10* 6 0.533 0.000E+00 0.000E+00 7 0.383 5.811E+09 1.721E-10* 7 0.557 0.000E+00 0.000E+00 8 0.354 5.511E+09 1.814E-10* 8 0.525 0.000E+00 0.000E+00 9 0.306 4.948E+09 2.021E-10* 9 0.541 0.000E+00 0.000E+00 10 0.291 4.796E+09 2.085E-10* 10 0.519 0.000E+00 0.000E+00