Open Access
Table A.6
Transition dipole moments of B′2Σ+ -X2Σ+, E2Σ+-X2Σ+, A2Π-X2Σ+, and C2Π-X2Σ+ in a.u.
R /a.u. | ![]() |
µE–x | µA–x | µC–X | R /a.u. | ![]() |
µE–X | µA–X | µC–X |
---|---|---|---|---|---|---|---|---|---|
1.50 | 0.06507 | 1.11609 | 1.06851 | 0.54395 | 5.00 | 1.21388 | 2.34546 | 0.55713 | 1.98835 |
1.60 | -0.05340 | 1.12998 | 1.14509 | 0.52413 | 5.10 | 1.23562 | 2.34957 | 0.51023 | 2.02553 |
1.70 | -0.10360 | 1.15494 | 1.20311 | 0.49792 | 5.20 | 1.24790 | 2.34464 | 0.46445 | 2.05969 |
1.80 | -0.13454 | 1.17327 | 1.24611 | 0.47347 | 5.30 | 1.25067 | 2.33107 | 0.42033 | 2.09067 |
1.90 | -0.15210 | 1.18765 | 1.27665 | 0.45278 | 5.40 | 1.24435 | 2.30941 | 0.37831 | 2.11837 |
2.00 | -0.16032 | 1.19947 | 1.29717 | 0.43586 | 5.50 | 1.22977 | 2.28054 | 0.33879 | 2.14286 |
2.10 | -0.16290 | 1.20922 | 1.30971 | 0.42230 | 5.60 | 1.20802 | 2.24536 | 0.30199 | 2.16431 |
2.20 | -0.16404 | 1.21669 | 1.31594 | 0.41195 | 5.70 | 1.18035 | 2.20495 | 0.26808 | 2.18295 |
2.30 | -0.16952 | 1.22094 | 1.31716 | 0.40460 | 5.80 | 1.14801 | 2.16038 | 0.23710 | 2.19908 |
2.40 | -0.18904 | 1.21982 | 1.31434 | 0.39990 | 5.90 | 1.11218 | 2.11272 | 0.20902 | 2.21298 |
2.50 | -0.24014 | 1.20807 | 1.30828 | 0.39713 | 6.00 | 1.07389 | 2.06299 | 0.18372 | 2.22497 |
2.52 | -0.25653 | 1.20338 | 1.30672 | 0.39695 | 6.10 | 1.03401 | 2.01213 | 0.16107 | 2.23532 |
2.54 | -0.27562 | 1.19757 | 1.30506 | 0.39676 | 6.20 | 0.99325 | 1.96095 | 0.14089 | 2.24428 |
2.56 | -0.29760 | 1.19037 | 1.30330 | 0.39662 | 6.30 | 0.95216 | 1.91015 | 0.12298 | 2.25207 |
2.58 | -0.32267 | 1.18155 | 1.30144 | 0.39655 | 6.40 | 0.91114 | 1.86033 | 0.10714 | 2.25886 |
2.60 | -0.35087 | 1.17081 | 1.29949 | 0.39656 | 6.50 | 0.87049 | 1.81194 | 0.09317 | 2.26481 |
2.62 | -0.38209 | 1.15788 | 1.29744 | 0.39663 | 6.60 | 0.83044 | 1.76534 | 0.08089 | 2.27003 |
2.64 | -0.41600 | 1.14253 | 1.29531 | 0.39678 | 6.70 | 0.79112 | 1.72080 | 0.07012 | 2.27460 |
2.66 | -0.45189 | 1.12467 | 1.29308 | 0.39702 | 6.80 | 0.75262 | 1.67850 | 0.06070 | 2.27852 |
2.68 | -0.48878 | 1.10435 | 1.29077 | 0.39732 | 6.90 | 0.71501 | 1.63861 | 0.05248 | 2.28154 |
2.70 | -0.52550 | 1.08189 | 1.28838 | 0.39769 | 7.00 | 0.67897 | 1.60291 | 0.04588 | 2.28183 |
2.72 | -0.56065 | 1.05786 | 1.28589 | 0.39813 | 7.10 | 0.64293 | 1.56722 | 0.03928 | 2.28213 |
2.74 | -0.59291 | 1.03301 | 1.28333 | 0.39866 | 7.20 | 0.60823 | 1.53455 | 0.03386 | 2.28403 |
2.76 | -0.62115 | 1.00820 | 1.28067 | 0.39926 | 7.30 | 0.57442 | 1.50397 | 0.02914 | 2.28605 |
2.78 | -0.64454 | 0.98431 | 1.27793 | 0.39993 | 7.40 | 0.54154 | 1.47546 | 0.02504 | 2.28805 |
2.80 | -0.66253 | 0.96205 | 1.27509 | 0.40069 | 7.50 | 0.50961 | 1.44899 | 0.02148 | 2.28997 |
2.82 | -0.67490 | 0.94195 | 1.27215 | 0.40154 | 7.60 | 0.47865 | 1.42447 | 0.01840 | 2.29178 |
2.84 | -0.68158 | 0.92443 | 1.26912 | 0.40237 | 7.70 | 0.44868 | 1.40183 | 0.01574 | 2.29350 |
2.86 | -0.68269 | 0.90955 | 1.26597 | 0.40329 | 7.80 | 0.41974 | 1.38098 | 0.01343 | 2.29510 |
2.88 | -0.67836 | 0.89754 | 1.26271 | 0.40421 | 7.90 | 0.39185 | 1.36186 | 0.01145 | 2.29662 |
2.90 | -0.66872 | 0.88823 | 1.25932 | 0.40511 | 8.00 | 0.36505 | 1.34441 | 0.00974 | 2.29803 |
2.92 | -0.65402 | 0.88182 | 1.25583 | 0.40593 | 8.10 | 0.33937 | 1.32858 | 0.00826 | 2.29936 |
2.94 | -0.63461 | 0.87831 | 1.25225 | 0.40654 | 8.20 | 0.31484 | 1.31432 | 0.00700 | 2.30061 |
2.96 | -0.61088 | 0.87760 | 1.24858 | 0.40701 | 8.30 | 0.29149 | 1.30164 | 0.00591 | 2.30178 |
2.98 | -0.58364 | 0.87967 | 1.24487 | 0.40739 | 8.40 | 0.26933 | 1.29050 | 0.00498 | 2.30287 |
3.00 | -0.55333 | 0.88420 | 1.24110 | 0.40773 | 8.50 | 0.24839 | 1.28093 | 0.00419 | 2.30390 |
3.02 | -0.52054 | 0.89093 | 1.23730 | 0.40812 | 8.60 | 0.22865 | 1.27294 | 0.00351 | 2.30486 |
3.04 | -0.48575 | 0.89958 | 1.23344 | 0.40862 | 8.70 | 0.21012 | 1.26658 | 0.00293 | 2.30576 |
3.06 | -0.44936 | 0.90991 | 1.22954 | 0.40925 | 8.80 | 0.19277 | 1.26189 | 0.00243 | 2.30661 |
3.08 | -0.41178 | 0.92171 | 1.22558 | 0.41006 | 8.90 | 0.17659 | 1.25894 | 0.00201 | 2.30740 |
3.10 | -0.37337 | 0.93478 | 1.22157 | 0.41109 | 9.00 | 0.16154 | 1.25780 | 0.00165 | 2.30814 |
3.12 | -0.33442 | 0.94898 | 1.21750 | 0.41235 | 9.10 | 0.14758 | 1.25856 | 0.00135 | 2.30884 |
3.14 | -0.29524 | 0.96417 | 1.21337 | 0.41386 | 9.20 | 0.13467 | 1.26132 | 0.00109 | 2.30949 |
3.16 | -0.25608 | 0.98023 | 1.20917 | 0.41563 | 9.30 | 0.12276 | 1.26619 | 0.00087 | 2.31010 |
3.18 | -0.21717 | 0.99706 | 1.20491 | 0.41768 | 9.40 | 0.11179 | 1.27330 | 0.00069 | 2.31068 |
3.20 | -0.17869 | 1.01455 | 1.20058 | 0.42002 | 9.50 | 0.10172 | 1.28278 | 0.00053 | 2.31120 |
3.22 | -0.14083 | 1.03262 | 1.19620 | 0.42268 | 9.60 | 0.09247 | 1.29478 | 0.00040 | 2.31171 |
3.24 | -0.10372 | 1.05122 | 1.19175 | 0.42565 | 9.70 | 0.08401 | 1.30945 | 0.00029 | 2.31219 |
3.26 | -0.06748 | 1.07016 | 1.18724 | 0.42895 | 9.80 | 0.07628 | 1.32696 | 0.00020 | 2.31262 |
3.28 | -0.03216 | 1.08959 | 1.18268 | 0.43265 | 9.90 | 0.06922 | 1.34748 | 0.00013 | 2.31304 |
3.30 | 0.00217 | 1.10934 | 1.17806 | 0.43673 | 10.00 | 0.06277 | 1.37118 | 0.00007 | 2.31343 |
3.32 | 0.03545 | 1.12935 | 1.17339 | 0.44124 | 10.10 | 0.05690 | 1.39821 | 0.00003 | 2.31379 |
3.34 | 0.06764 | 1.14959 | 1.16868 | 0.44618 | 10.20 | 0.05156 | 1.42869 | 0.00000 | 2.31414 |
3.36 | 0.09874 | 1.17000 | 1.16392 | 0.45158 | 10.30 | 0.04670 | 1.46272 | 0.00002 | 2.31445 |
3.38 | 0.12876 | 1.19059 | 1.15912 | 0.45758 | 10.40 | 0.04228 | 1.50031 | 0.00004 | 2.31473 |
3.40 | 0.15763 | 1.21124 | 1.15428 | 0.46404 | 10.50 | 0.03827 | 1.54140 | 0.00005 | 2.31499 |
3.42 | 0.18537 | 1.23195 | 1.14940 | 0.47102 | 10.60 | 0.03462 | 1.58581 | 0.00006 | 2.31524 |
3.44 | 0.21200 | 1.25268 | 1.14449 | 0.47855 | 10.70 | 0.03132 | 1.63320 | 0.00007 | 2.31546 |
3.46 | 0.23753 | 1.27340 | 1.13955 | 0.48663 | 10.80 | 0.02831 | 1.68309 | 0.00007 | 2.31566 |
3.48 | 0.26199 | 1.29411 | 1.13457 | 0.49530 | 10.90 | 0.02559 | 1.73480 | 0.00008 | 2.31584 |
3.50 | 0.28538 | 1.31476 | 1.12956 | 0.50431 | 11.00 | 0.02312 | 1.78752 | 0.00009 | 2.31601 |
3.60 | 0.38896 | 1.41740 | 1.10370 | 0.56187 | 11.10 | 0.02088 | 1.84032 | 0.00009 | 2.31615 |
3.70 | 0.47507 | 1.51945 | 1.07581 | 0.64458 | 11.20 | 0.01885 | 1.89219 | 0.00010 | 2.31629 |
3.80 | 0.54917 | 1.62399 | 1.04367 | 0.78285 | 11.30 | 0.01701 | 1.94220 | 0.00010 | 2.31641 |
3.90 | 0.61713 | 1.73132 | 1.00923 | 1.01903 | 11.40 | 0.01534 | 1.98949 | 0.00010 | 2.31654 |
4.00 | 0.68463 | 1.82838 | 0.97675 | 1.26457 | 11.50 | 0.01384 | 2.03340 | 0.00011 | 2.31665 |
4.10 | 0.75004 | 1.91517 | 0.94303 | 1.43607 | 11.60 | 0.01248 | 2.07350 | 0.00011 | 2.31676 |
4.20 | 0.81356 | 1.99364 | 0.90700 | 1.54953 | 11.70 | 0.01125 | 2.10954 | 0.00011 | 2.31688 |
4.30 | 0.87554 | 2.06504 | 0.86849 | 1.63592 | 11.80 | 0.01014 | 2.14152 | 0.00010 | 2.31698 |
4.40 | 0.93543 | 2.13502 | 0.83158 | 1.71612 | 11.90 | 0.00914 | 2.16959 | 0.00010 | 2.31710 |
4.50 | 0.99342 | 2.19046 | 0.78895 | 1.76705 | 12.00 | 0.00824 | 2.19403 | 0.00010 | 2.31722 |
4.60 | 1.04838 | 2.23844 | 0.74459 | 1.81542 | 12.10 | 0.00744 | 2.21516 | 0.00010 | 2.31732 |
4.70 | 1.09921 | 2.27835 | 0.69880 | 1.86177 | 12.20 | 0.00672 | 2.23337 | 0.00009 | 2.31744 |
4.80 | 1.14460 | 2.30970 | 0.65196 | 1.90617 | 12.30 | 0.00607 | 2.24903 | 0.00009 | 2.31754 |
4.90 | 1.18323 | 2.33217 | 0.60456 | 1.94846 | 12.40 | 0.00549 | 2.26252 | 0.00009 | 2.31765 |
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