atomic number =   44
effective nuclear charge =   44
electron count =   47
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 =    3
density in atomic units:
0.76353000E+05
0.27666876E+03
0.67069702E+02
0.36918747E+02
0.16761457E+02
0.74807239E+01
0.35599759E+01
0.21496837E+01
0.16635879E+01
0.13816739E+01
0.11284584E+01
0.90912926E+00
0.70661861E+00
0.53500342E+00
0.40883026E+00
0.31094885E+00
0.23479086E+00
0.17963821E+00
0.13858402E+00
0.10794692E+00
0.85427634E-01
0.69268696E-01
0.56556039E-01
0.46645589E-01
0.39212838E-01
0.33273079E-01
0.28546803E-01
0.24766641E-01
0.21661526E-01
0.19103423E-01
0.17084301E-01
0.15237037E-01
0.13760776E-01
0.12485718E-01
0.11344101E-01
0.10365159E-01
0.94851349E-02
0.86992746E-02
0.80087213E-02
0.73901727E-02
0.68061287E-02
0.62949243E-02
0.58192150E-02
0.53777248E-02
0.49801408E-02
0.45967973E-02
0.42409231E-02
0.39252620E-02
0.36213312E-02
0.33396629E-02
0.30769932E-02
0.28313627E-02
0.26051577E-02
0.23970315E-02
0.22029958E-02
0.20227432E-02
0.18538046E-02
0.16984831E-02
0.15557986E-02
0.14238269E-02
0.13027653E-02
0.11906556E-02
0.10880707E-02
0.99364563E-03
0.90662326E-03
0.82820602E-03
0.75615791E-03
0.68930897E-03
0.62812545E-03
0.57220092E-03
0.52158517E-03
0.47548677E-03
0.43322079E-03
0.39493435E-03
0.35973571E-03
0.32764321E-03
0.29846886E-03
0.27187367E-03
0.24771699E-03
0.22589596E-03
0.20583236E-03
0.18744195E-03
0.17067359E-03
0.15541243E-03
0.14162468E-03
0.12913828E-03
0.11767325E-03
0.10723105E-03
0.97717857E-04
0.88956360E-04
0.81067112E-04
0.73837786E-04
0.67206733E-04
0.61240928E-04
0.55777848E-04
0.50801566E-04
0.46302270E-04
0.42172473E-04
0.38392078E-04
0.34976012E-04
