atomic number =   79
effective nuclear charge =   79
electron count =   76
net charge =    3
basis set = approximate basis set limit (UGBS)      
exchange correlation functional = PW91PW91            
cutoff radius (picometer) =  500
number of shells =  100
prepared by = Thomas A. Manz      
prepared date = July 2010           
magnetization =    2
density in atomic units:
0.52040300E+06
0.56721448E+03
0.11973117E+03
0.59172043E+02
0.34344536E+02
0.17518572E+02
0.85296850E+01
0.45613050E+01
0.29694476E+01
0.21315122E+01
0.15786194E+01
0.11831377E+01
0.86898232E+00
0.62700564E+00
0.45755425E+00
0.33470526E+00
0.24116389E+00
0.17575970E+00
0.12914306E+00
0.94591498E-01
0.70512630E-01
0.53219046E-01
0.40246408E-01
0.30689968E-01
0.23645345E-01
0.18330341E-01
0.14294681E-01
0.11286501E-01
0.89319889E-02
0.71326317E-02
0.57256231E-02
0.46307039E-02
0.37560847E-02
0.30655835E-02
0.25159889E-02
0.20618127E-02
0.16945027E-02
0.13972619E-02
0.11572036E-02
0.95708232E-03
0.79572841E-03
0.66014845E-03
0.54819958E-03
0.45935542E-03
0.38388447E-03
0.32022368E-03
0.26837288E-03
0.22518712E-03
0.18908862E-03
0.15880566E-03
0.13351341E-03
0.11214536E-03
0.94593859E-04
0.79942867E-04
0.67553439E-04
0.57072299E-04
0.48255042E-04
0.40805582E-04
0.34545006E-04
0.29350742E-04
0.24890369E-04
0.21140988E-04
0.17978753E-04
0.15282709E-04
0.13000888E-04
0.11074711E-04
0.94291463E-05
0.80154468E-05
0.68146842E-05
0.57524812E-05
0.48845868E-05
0.41407470E-05
0.35128778E-05
0.29870223E-05
0.25287511E-05
0.21321077E-05
0.18017629E-05
0.15152987E-05
0.12850521E-05
0.10919434E-05
0.92274428E-06
0.78296733E-06
0.66090206E-06
0.56023805E-06
0.47464570E-06
0.40199558E-06
0.33941220E-06
0.28757185E-06
0.24288275E-06
0.20464898E-06
0.17303530E-06
0.14677552E-06
0.12361217E-06
0.10444825E-06
0.88513069E-07
0.74468545E-07
0.62842211E-07
0.52975384E-07
0.44489511E-07
0.37595022E-07
