Advances in Physical Chemistry / 2018 / Article / Tab 3

Research Article

Solution of the Rovibrational Schrödinger Equation of a Molecule Using the Volterra Integral Equation

Table 3

The eigenvalues , the rotational constants , and the centrifugal distortion constants , , of the pure vibrational levels of the ab initio potential of the electronic state of ZnBr molecule.

v  × 102 cm−1  × 108 cm−1  × 1014 cm−1  × 1019 cm−1

073.93a4.451031.612180.912410.14521
1221.794.447441.633630.904720.19051
2368.994.443501.661270.924630.05234
3515.454.439351.679430.876150.27340
4661.244.434811.706141.009840.15840
5806.324.430281.716520.842280.29044
6950.774.425371.736090.940560.11801
71094.614.420301.750340.119960.47912
81237.824.413701.784340.053490.84506
91380.274.405761.790320.590081.70130
101522.024.397751.739592.383502.47151
111663.354.391791.743840.888055.98681
121804.324.385291.882280.623462.15342
131944.464.377621.955633.055688.56892
142083.654.371841.867650.655884.32335
152222.284.365961.889412.908450.21492
162360.264.356941.907471.647600.79699
172497.544.348551.876643201368.65452
182634.294.341491.968540.200664.88072
192770.334.333402.002301.649886.52090
202905.644.325741.958890.248955.04669
213040.344.317421.983470.263141.24147
223174.384.308582.003032.706971.67678
233307.784.300412.034180.911781.17857
243440.524.291942.061181.103903.42636
253572.594.283402.057260.548731.82649
263704.004.274612.072840.967851.25401
273834.774.265662.090891.584380.12407
283964.894.256772.109010.808081.31828
294094.364.247672.118761.048400.30910
304223.184.238492.129360.865720.05289
314351.374.229142.138891.086290.85910
324478.924.219712.151871.104380.34952
334605.844.210192.164760.785630.70987
344732.144.200492.172600.994471.02375
354857.804.190692.185071.115340.64514
364982.854.180812.192930.942660.49012
375107.274.170822.203221.059930.17041
385231.084.160742.213930.947211.19382
395354.284.15052.221800.975561.04020
405476.874.140262.231341.128580.13659
415598.854.129912.241350.948460.81640
425720.224.119452.248011.012500.74932
435840.994.108912.256801.061470.53996
445961.174.098302.265320.886680.28173
456080.744.087582.271801.090590.75800
466199.734.076802.280521.122100.61602
476318.124.065962.286910.914080.02149
486435.924.055032.293641.026520.71959
496553.134.044032.301551.04383.25215
506669.764.032962.307810.959090.10453
516785.814.021832.312371.148470.87011
526901.284.010632.320801.058330.81187
537016.173.999382.326620.956410.09161
547130.493.988062.331221.132540.51320
557244.233.976692.337501.032950.81658
567357.413.965272.343050.935530.06755
577470.023.953782.347751.099950.66094
587582.063.942252.353111.135540.84554
597693.543.930682.357460.951760.06318
607804.463.919052.361031.097310.78457
617914.823.907372.366861.111900.93709
628024.623.895662.370970.901130.83185
638133.873.883892.373440.993410.85369
648242.573.872092.377921.143850.17720
658350.733.860262.381090.989470.70085

Data published in [17] calculated by the present software.