atomic number =   44
effective nuclear charge =   44
electron count =   38
net charge =    6
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:
0.76364602E+05
0.27575214E+03
0.66841850E+02
0.36889069E+02
0.16748354E+02
0.74677238E+01
0.35408432E+01
0.21083293E+01
0.15914737E+01
0.12633877E+01
0.99190420E+00
0.75227654E+00
0.54600549E+00
0.38180995E+00
0.26510152E+00
0.18360642E+00
0.12305257E+00
0.82942247E-01
0.56347832E-01
0.37636876E-01
0.25816904E-01
0.17775325E-01
0.12314823E-01
0.87000588E-02
0.61967429E-02
0.44863918E-02
0.32854939E-02
0.24723422E-02
0.18706889E-02
0.14463335E-02
0.11072468E-02
0.88964612E-03
0.70135045E-03
0.56119543E-03
0.45992425E-03
0.37093388E-03
0.30265393E-03
0.24885687E-03
0.20500791E-03
0.16687854E-03
0.13970843E-03
0.11373520E-03
0.93002709E-04
0.78272758E-04
0.64349930E-04
0.53323995E-04
0.44687244E-04
0.36725713E-04
0.30597981E-04
0.25357562E-04
0.21125976E-04
0.17517355E-04
0.14654814E-04
0.12302999E-04
0.10316056E-04
0.86584359E-05
0.72916932E-05
0.61245378E-05
0.51432849E-05
0.43692326E-05
0.36527949E-05
0.30954061E-05
0.26189152E-05
0.22103770E-05
0.18651702E-05
0.15558824E-05
0.13006229E-05
0.10975382E-05
0.92876064E-06
0.78755636E-06
0.68016652E-06
0.57865373E-06
0.49756250E-06
0.42859236E-06
0.36570654E-06
0.30903283E-06
0.26246639E-06
0.22031234E-06
0.18646303E-06
0.15840490E-06
0.13316894E-06
0.11254599E-06
0.94869705E-07
0.79824723E-07
0.67030570E-07
0.56516338E-07
0.47046296E-07
0.39654253E-07
0.33087151E-07
0.27514632E-07
0.22944850E-07
0.19145221E-07
0.15843332E-07
0.13108314E-07
0.10873291E-07
0.89252401E-08
0.73439375E-08
0.60252212E-08
0.49190736E-08
0.40196215E-08
