atomic number =   45
effective nuclear charge =   45
electron count =   42
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 =    4
density in atomic units:
0.82232797E+05
0.28200308E+03
0.70970406E+02
0.37881031E+02
0.16254219E+02
0.70816345E+01
0.34965262E+01
0.22761555E+01
0.18228314E+01
0.15009668E+01
0.11959351E+01
0.93236369E+00
0.69838333E+00
0.50759274E+00
0.37126014E+00
0.26974431E+00
0.19275917E+00
0.13887329E+00
0.10038806E+00
0.72475024E-01
0.53003214E-01
0.39463211E-01
0.29383691E-01
0.22011457E-01
0.16743653E-01
0.12812826E-01
0.98839728E-02
0.77177249E-02
0.60572177E-02
0.47968249E-02
0.38534130E-02
0.30861548E-02
0.25045392E-02
0.20442437E-02
0.16708180E-02
0.13724028E-02
0.11286164E-02
0.93071652E-03
0.77214598E-03
0.64253167E-03
0.53326390E-03
0.44592161E-03
0.37291832E-03
0.31238975E-03
0.26318894E-03
0.22064583E-03
0.18514936E-03
0.15690748E-03
0.13235943E-03
0.11186496E-03
0.94618743E-04
0.80056532E-04
0.67845722E-04
0.57671146E-04
0.49000995E-04
0.41693649E-04
0.35406043E-04
0.30150106E-04
0.25729460E-04
0.21900179E-04
0.18707555E-04
0.15938955E-04
0.13591807E-04
0.11599547E-04
0.98832634E-05
0.84546682E-05
0.72316325E-05
0.61717819E-05
0.52782962E-05
0.45764368E-05
0.39609649E-05
0.34471350E-05
0.29924104E-05
0.25961838E-05
0.22588326E-05
0.19635422E-05
0.17051784E-05
0.14855319E-05
0.12909110E-05
0.11234528E-05
0.97828456E-06
0.84869947E-06
0.73662972E-06
0.63971760E-06
0.55590141E-06
0.48244999E-06
0.42137916E-06
0.36598914E-06
0.31748772E-06
0.27646570E-06
0.23968883E-06
0.20745927E-06
0.18029124E-06
0.15644977E-06
0.13515115E-06
0.11776645E-06
0.10201160E-06
0.88038490E-07
0.77225380E-07
0.66276165E-07
