(* The following table displays the dipole moment functions between the (1)1Sigma+ state (X1Sigma+ state) (* with the seven lowest Sigma states of NaCs, for singlet transitions. (* Distances and dipole moments are in atomic units, corresponding respectively to (* 1 a.u. (length) = 1 bohr = 0.0529177 nm, and (* 1 a.u. (dipole moment) = 2.54158059 Debye. (* All states are identified with their number with increasing energy. (* When both indices are equal, the function corresponds to the permanent dipole moment. (* ------------------------------------------------------------------------------------------------------- (* Table 1: (1)1Sigma+ -(1-7)1Sigma+ transitions (* R 1-1 1-2 1-3 1-4 1-5 1-6 1-7 (* ------------------------------------------------------------------------------------------------------- 0.000 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 3.200 -0.565700E+00 0.322290E+01 -0.172630E+01 0.196600E+00 0.439000E-01 0.365500E+00 0.875000E-01 3.400 -0.850700E+00 0.317010E+01 -0.177170E+01 0.390300E+00 0.444000E-01 0.328800E+00 0.103800E+00 3.600 -0.105770E+01 0.313720E+01 -0.176420E+01 0.571200E+00 0.106100E+00 0.265500E+00 0.129800E+00 3.800 -0.120500E+01 0.312920E+01 -0.170440E+01 0.754100E+00 0.179200E+00 0.180500E+00 0.155200E+00 4.200 -0.138050E+01 0.319660E+01 -0.136420E+01 0.116800E+01 0.166500E+00 0.567000E-01 0.125800E+00 4.600 -0.146940E+01 0.332060E+01 -0.778700E+00 0.144530E+01 0.997000E-01 0.335300E+00 0.371000E-01 4.800 -0.149940E+01 0.336620E+01 -0.484800E+00 0.149110E+01 0.250300E+00 0.456400E+00 -0.100200E+00 5.000 -0.152570E+01 0.339460E+01 -0.246300E+00 0.150120E+01 0.357500E+00 0.553000E+00 -0.150800E+00 5.200 -0.155060E+01 0.341440E+01 -0.814000E-01 0.149840E+01 0.417800E+00 0.624400E+00 -0.184600E+00 5.400 -0.157580E+01 0.343410E+01 -0.131000E-01 0.149350E+01 0.444500E+00 0.674800E+00 -0.198900E+00 5.600 -0.160200E+01 0.345870E+01 -0.506000E-01 0.149030E+01 0.450400E+00 0.708700E+00 -0.196700E+00 5.800 -0.162950E+01 0.348950E+01 -0.461000E-01 0.148950E+01 0.444100E+00 0.729500E+00 -0.184300E+00 6.000 -0.165830E+01 0.352610E+01 0.124000E-01 0.149120E+01 0.429900E+00 0.739900E+00 -0.166300E+00 6.200 -0.168810E+01 0.356780E+01 0.402000E-01 0.149500E+01 0.409600E+00 0.741800E+00 -0.147100E+00 6.400 -0.171840E+01 0.361370E+01 0.103800E+00 0.150100E+01 0.383600E+00 0.737000E+00 -0.128700E+00 6.600 -0.174890E+01 0.366290E+01 0.172700E+00 0.150940E+01 0.351200E+00 0.726800E+00 -0.112000E+00 6.800 -0.177880E+01 0.371470E+01 0.242900E+00 0.152050E+01 0.311200E+00 0.712400E+00 -0.970000E-01 7.000 -0.180770E+01 0.376850E+01 0.312000E+00 0.153440E+01 0.262500E+00 0.694400E+00 -0.833000E-01 7.200 -0.183460E+01 0.382380E+01 0.378300E+00 0.155080E+01 0.204300E+00 0.673600E+00 -0.702000E-01 7.400 -0.185900E+01 0.387990E+01 0.441200E+00 0.156890E+01 0.136800E+00 0.650300E+00 -0.568000E-01 7.600 -0.188000E+01 0.393640E+01 0.500200E+00 0.158780E+01 0.616000E-01 0.624800E+00 -0.422000E-01 7.800 -0.189680E+01 0.399270E+01 0.555100E+00 0.160650E+01 0.181000E-01 0.597500E+00 -0.256000E-01 8.200 -0.191400E+01 0.410220E+01 0.651600E+00 0.164360E+01 -0.175700E+00 0.537400E+00 0.154000E-01 8.400 -0.191280E+01 0.415430E+01 0.692500E+00 0.166350E+01 -0.246700E+00 0.504800E+00 0.396000E-01 8.600 -0.190380E+01 0.420370E+01 0.727900E+00 0.168610E+01 -0.309700E+00 0.470600E+00 0.657000E-01 8.800 -0.188630E+01 0.424970E+01 0.756800E+00 0.171240E+01 -0.364000E+00 0.434700E+00 0.926000E-01 9.000 -0.185990E+01 0.429150E+01 0.778300E+00 0.174340E+01 -0.409700E+00 0.397200E+00 0.119000E+00 9.200 -0.182410E+01 0.432820E+01 0.791200E+00 0.177990E+01 -0.447200E+00 0.358300E+00 0.143800E+00 9.400 -0.177880E+01 0.435900E+01 0.793900E+00 0.182210E+01 -0.476800E+00 0.318100E+00 0.165900E+00 9.600 -0.172410E+01 0.438310E+01 0.784500E+00 0.187020E+01 -0.499200E+00 0.277000E+00 0.184200E+00 9.800 -0.166040E+01 0.439980E+01 0.760800E+00 0.192420E+01 -0.514700E+00 0.235500E+00 0.197800E+00 10.000 -0.158860E+01 0.440840E+01 0.720200E+00 0.198350E+01 -0.523800E+00 0.194800E+00 0.205800E+00 10.200 -0.150950E+01 0.440850E+01 0.659900E+00 0.204710E+01 -0.526700E+00 0.156200E+00 0.207400E+00 10.400 -0.142460E+01 0.439970E+01 0.577300E+00 0.211330E+01 -0.523900E+00 0.122000E+00 0.202000E+00 10.600 -0.133530E+01 0.438210E+01 0.470300E+00 0.217930E+01 -0.515800E+00 0.954000E-01 0.189800E+00 10.800 -0.124300E+01 0.435590E+01 0.338900E+00 0.224140E+01 -0.502900E+00 0.796000E-01 0.171900E+00 11.000 -0.114960E+01 0.432150E+01 0.185800E+00 0.229520E+01 -0.485900E+00 0.770000E-01 0.150600E+00 11.200 -0.105640E+01 0.427980E+01 -0.174000E-01 0.233690E+01 -0.465600E+00 0.881000E-01 0.128500E+00 11.400 -0.964900E+00 0.423170E+01 -0.157200E+00 0.236410E+01 -0.443000E+00 0.110900E+00 0.108500E+00 11.600 -0.876400E+00 0.417810E+01 -0.328300E+00 0.237740E+01 -0.419200E+00 0.141600E+00 0.923000E-01 11.800 -0.791800E+00 0.412040E+01 -0.488300E+00 0.237900E+01 -0.395700E+00 0.176000E+00 0.811000E-01 12.000 -0.711900E+00 0.405970E+01 -0.632300E+00 0.237250E+01 -0.374200E+00 0.210400E+00 0.749000E-01 12.200 -0.637200E+00 0.399730E+01 -0.758500E+00 0.236110E+01 -0.356500E+00 0.242200E+00 0.729000E-01 12.400 -0.568100E+00 0.393430E+01 -0.867200E+00 0.234740E+01 -0.344400E+00 0.269900E+00 0.735000E-01 12.600 -0.504600E+00 0.387170E+01 -0.959600E+00 0.233280E+01 -0.340100E+00 0.292700E+00 0.754000E-01 12.800 -0.446700E+00 0.381050E+01 -0.103750E+01 0.231830E+01 -0.345600E+00 0.310500E+00 0.775000E-01 13.000 -0.394300E+00 0.375150E+01 -0.110250E+01 0.230380E+01 -0.363100E+00 0.323600E+00 0.793000E-01 13.200 -0.347100E+00 0.369550E+01 -0.115600E+01 0.228870E+01 -0.394900E+00 0.332400E+00 0.807000E-01 13.400 -0.304700E+00 0.364290E+01 -0.119930E+01 0.227200E+01 -0.443200E+00 0.337400E+00 0.818000E-01 13.600 -0.266900E+00 0.359420E+01 -0.123320E+01 0.225190E+01 -0.510500E+00 0.339200E+00 0.826000E-01 13.800 -0.233200E+00 0.354980E+01 -0.125860E+01 0.222560E+01 -0.598700E+00 0.338300E+00 0.834000E-01 14.000 -0.203300E+00 0.350980E+01 -0.127590E+01 0.218990E+01 -0.709000E+00 0.335300E+00 0.842000E-01 14.200 -0.176900E+00 0.347450E+01 -0.128570E+01 0.214110E+01 -0.840500E+00 0.330400E+00 0.852000E-01 14.400 -0.153500E+00 0.344370E+01 -0.128830E+01 0.207580E+01 -0.989000E+00 0.324100E+00 0.863000E-01 14.600 -0.132800E+00 0.341770E+01 -0.128390E+01 0.199320E+01 -0.114660E+01 0.316600E+00 0.876000E-01 15.000 -0.986000E-01 0.337880E+01 -0.125510E+01 0.178900E+01 -0.144770E+01 0.299400E+00 0.907000E-01 15.200 -0.845000E-01 0.336550E+01 -0.123110E+01 0.168040E+01 -0.157490E+01 0.290100E+00 0.925000E-01 15.800 -0.517000E-01 0.334640E+01 -0.112400E+01 0.139170E+01 -0.184330E+01 0.260900E+00 0.990000E-01 16.400 -0.295000E-01 0.334910E+01 -0.972900E+00 0.118240E+01 -0.199330E+01 0.232100E+00 0.106300E+00 16.600 -0.239000E-01 0.335260E+01 -0.915300E+00 0.112700E+01 -0.202820E+01 0.222900E+00 0.108900E+00 16.800 -0.189000E-01 0.335670E+01 -0.855200E+00 0.107700E+01 -0.205810E+01 0.214000E+00 0.111600E+00 17.000 -0.145000E-01 0.336090E+01 -0.793400E+00 0.103160E+01 -0.208420E+01 0.205400E+00 0.114300E+00 17.200 -0.107000E-01 0.336500E+01 -0.730600E+00 0.990000E+00 -0.210700E+01 0.197000E+00 0.117000E+00 17.400 -0.730000E-02 0.336880E+01 -0.667500E+00 0.951400E+00 -0.212730E+01 0.189000E+00 0.119700E+00 17.600 -0.440000E-02 0.337190E+01 -0.604700E+00 0.915500E+00 -0.214540E+01 0.181400E+00 0.122400E+00 17.800 -0.180000E-02 0.337440E+01 -0.542900E+00 0.881500E+00 -0.216180E+01 0.174000E+00 0.125200E+00 18.000 0.500000E-03 0.337610E+01 -0.482700E+00 0.849200E+00 -0.217660E+01 0.167000E+00 0.127900E+00 18.200 0.250000E-02 0.337700E+01 -0.424500E+00 0.818200E+00 -0.219010E+01 0.160200E+00 0.130600E+00 18.400 0.430000E-02 0.337720E+01 -0.368700E+00 0.788200E+00 -0.220260E+01 0.153800E+00 0.133300E+00 18.600 0.580000E-02 0.337660E+01 -0.315900E+00 0.759000E+00 -0.221400E+01 0.147600E+00 0.135900E+00 18.800 0.720000E-02 0.337550E+01 -0.266300E+00 0.730500E+00 -0.222460E+01 0.141800E+00 0.138600E+00 19.000 0.840000E-02 0.337370E+01 -0.220100E+00 0.702600E+00 -0.223440E+01 0.136200E+00 0.141200E+00 19.200 0.950000E-02 0.337150E+01 -0.177600E+00 0.675400E+00 -0.224350E+01 0.130800E+00 0.143800E+00 19.600 0.112000E-01 0.336570E+01 -0.103700E+00 0.623400E+00 -0.225990E+01 0.120900E+00 0.148900E+00 19.800 0.119000E-01 0.336240E+01 -0.724000E-01 0.598900E+00 -0.226730E+01 0.116300E+00 0.151400E+00 20.000 0.126000E-01 0.335880E+01 -0.447000E-01 0.575800E+00 -0.227420E+01 0.111900E+00 0.153800E+00 20.200 0.131000E-01 0.335500E+01 -0.203000E-01 0.554400E+00 -0.228050E+01 0.107700E+00 0.156300E+00 20.400 0.136000E-01 0.335110E+01 0.900000E-03 0.534800E+00 -0.228640E+01 0.103700E+00 0.158700E+00 20.600 0.140000E-01 0.334710E+01 0.193000E-01 0.517600E+00 -0.229170E+01 0.100000E+00 0.161000E+00 20.800 0.144000E-01 0.334310E+01 0.351000E-01 0.503200E+00 -0.229640E+01 0.964000E-01 0.163300E+00 21.000 0.147000E-01 0.333890E+01 0.485000E-01 0.492300E+00 -0.230050E+01 0.929000E-01 0.165600E+00 21.200 0.150000E-01 0.333480E+01 0.599000E-01 0.485900E+00 -0.230370E+01 0.897000E-01 0.167900E+00 21.400 0.152000E-01 0.333070E+01 0.695000E-01 0.485700E+00 -0.230570E+01 0.866000E-01 0.170100E+00 21.600 0.154000E-01 0.332660E+01 0.775000E-01 0.495000E+00 -0.230580E+01 0.837000E-01 0.172300E+00 21.800 0.156000E-01 0.332260E+01 0.842000E-01 0.520200E+00 -0.230250E+01 0.810000E-01 0.174400E+00 22.000 0.157000E-01 0.331850E+01 0.896000E-01 0.576900E+00 -0.229130E+01 0.784000E-01 0.176500E+00 22.200 0.158000E-01 0.331460E+01 0.941000E-01 0.712400E+00 -0.225530E+01 0.760000E-01 0.178500E+00 22.400 0.159000E-01 0.331070E+01 0.976000E-01 0.113450E+01 -0.207790E+01 0.737000E-01 0.180500E+00 22.600 0.160000E-01 0.330690E+01 0.100400E+00 0.214630E+01 -0.100490E+01 0.716000E-01 0.182500E+00 22.800 0.160000E-01 0.330320E+01 0.102500E+00 0.235460E+01 -0.289200E+00 0.696000E-01 0.184400E+00 23.000 0.161000E-01 0.329950E+01 0.104100E+00 0.237300E+01 -0.879000E-01 0.677000E-01 0.186300E+00 23.200 0.161000E-01 0.329590E+01 0.105200E+00 0.237710E+01 0.630000E-02 0.660000E-01 0.188100E+00 23.400 0.161000E-01 0.329250E+01 0.105900E+00 0.237920E+01 0.343000E-01 0.645000E-01 0.189900E+00 23.600 0.161000E-01 0.328910E+01 0.106200E+00 0.238120E+01 0.566000E-01 0.631000E-01 0.191700E+00 23.800 0.160000E-01 0.328580E+01 0.106300E+00 0.238320E+01 0.694000E-01 0.618000E-01 0.193400E+00 24.000 0.160000E-01 0.328250E+01 0.106100E+00 0.238530E+01 0.767000E-01 0.607000E-01 0.195100E+00 24.200 0.159000E-01 0.327940E+01 0.105700E+00 0.238750E+01 0.805000E-01 0.597000E-01 0.196800E+00 24.400 0.159000E-01 0.327640E+01 0.105100E+00 0.238970E+01 0.821000E-01 0.589000E-01 0.198400E+00 24.600 0.158000E-01 0.327340E+01 0.104300E+00 0.239190E+01 0.822000E-01 0.583000E-01 0.200000E+00 24.800 0.157000E-01 0.327050E+01 0.103500E+00 0.239410E+01 0.813000E-01 0.578000E-01 0.201500E+00 25.000 0.156000E-01 0.326770E+01 0.102500E+00 0.239630E+01 0.796000E-01 0.575000E-01 0.203100E+00 25.200 0.155000E-01 0.326500E+01 0.101400E+00 0.239840E+01 0.774000E-01 0.573000E-01 0.204500E+00 25.400 0.155000E-01 0.326240E+01 0.100200E+00 0.240060E+01 0.747000E-01 0.574000E-01 0.206000E+00 25.600 0.154000E-01 0.325980E+01 0.990000E-01 0.240260E+01 0.717000E-01 0.576000E-01 0.207400E+00 25.800 0.152000E-01 0.325740E+01 0.978000E-01 0.240470E+01 0.683000E-01 0.580000E-01 0.208700E+00 26.000 0.151000E-01 0.325490E+01 0.964000E-01 0.240670E+01 0.647000E-01 0.585000E-01 0.210100E+00 26.200 0.150000E-01 0.325260E+01 0.951000E-01 0.240860E+01 0.609000E-01 0.591000E-01 0.211300E+00 26.400 0.149000E-01 0.325030E+01 0.937000E-01 0.241050E+01 0.568000E-01 0.599000E-01 0.212600E+00 26.600 0.148000E-01 0.324810E+01 0.924000E-01 0.241240E+01 0.526000E-01 0.606000E-01 0.213800E+00 26.800 0.147000E-01 0.324600E+01 0.910000E-01 0.241420E+01 0.482000E-01 0.613000E-01 0.214900E+00 28.000 0.139000E-01 0.323420E+01 0.826000E-01 0.242410E+01 0.246000E-01 0.221100E+00 0.667000E-01 29.800 0.129000E-01 0.321960E+01 0.710000E-01 0.243620E+01 0.880000E-02 0.227700E+00 0.525000E-01 30.000 0.128000E-01 0.321830E+01 0.698000E-01 0.243750E+01 0.800000E-02 0.228200E+00 0.510000E-01 30.200 0.126000E-01 0.321690E+01 0.686000E-01 0.243860E+01 0.730000E-02 0.228800E+00 0.495000E-01 30.400 0.125000E-01 0.321550E+01 0.675000E-01 0.243980E+01 0.670000E-02 0.229300E+00 0.481000E-01 30.600 0.124000E-01 0.321420E+01 0.663000E-01 0.244090E+01 0.620000E-02 0.229800E+00 0.467000E-01 30.800 0.123000E-01 0.321270E+01 0.652000E-01 0.244180E+01 0.580000E-02 0.230200E+00 0.454000E-01