atomic number =   81
effective nuclear charge =   81
electron count =   36
net charge =   45
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           
net magnetization =    0
density in atomic units:
0.56218350E+06
0.53113733E+03
0.83562683E+02
0.21892242E+02
0.10400126E+02
0.43734059E+01
0.15100645E+01
0.43362433E+00
0.12048069E+00
0.32729164E-01
0.85136266E-02
0.23435955E-02
0.61880052E-03
0.14868658E-03
0.37006132E-04
0.93319813E-05
0.22294307E-05
0.59498609E-06
0.18154086E-06
0.57061754E-07
0.19982441E-07
0.10851096E-07
0.10054981E-07
0.10297006E-07
0.91715311E-08
0.67857640E-08
0.40782595E-08
0.19146291E-08
0.60231070E-09
0.15262308E-09
0.29490130E-09
0.71377565E-09
0.11433611E-08
0.14290820E-08
0.15174972E-08
0.14203237E-08
0.11919429E-08
0.90155877E-09
0.61429345E-09
0.36617712E-09
0.18256680E-09
0.69762383E-10
0.19906174E-10
0.19105066E-10
0.49732690E-10
0.97291154E-10
0.14689606E-09
0.18867685E-09
0.21856271E-09
0.23352933E-09
0.23374142E-09
0.22128065E-09
0.19952985E-09
0.17196522E-09
0.14150550E-09
0.11083857E-09
0.82105767E-10
0.57104679E-10
0.36757035E-10
0.21367921E-10
0.10708094E-10
0.43732010E-11
0.17500774E-11
0.20550564E-11
0.45279657E-11
0.83580070E-11
0.12942097E-10
0.17790247E-10
0.22393474E-10
0.26430871E-10
0.29656073E-10
0.31971054E-10
0.33350919E-10
0.33879677E-10
0.33469647E-10
0.32380838E-10
0.30692279E-10
0.28517740E-10
0.26015216E-10
0.23332680E-10
0.20529262E-10
0.17710840E-10
0.14983298E-10
0.12418351E-10
0.10081567E-10
0.79934982E-11
0.61539788E-11
0.45817616E-11
0.32747776E-11
0.22117566E-11
0.14034053E-11
0.81237805E-12
0.41766094E-12
0.20051494E-12
0.13027253E-12
0.18272860E-12
0.33213205E-12
0.55786327E-12
0.83944115E-12
0.11555744E-11
