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Data format of PACKPROF.ASC Format by element: 33 rows First row: 2 fields separated by blank(s) Atomic-Number Number_of_Shells Second row: Number_of_Shells fields separated by blanks Binding[1] .. Binding[number_of_shells] Next 31 rows: Number_of_Shells fields separated by blanks Profile[1,j] .. Profile[number_of_shells,j] where Atomic-Number : an integer number between 1 and 92. Number_of_Shells : an integer number between 1 and 25. Binding[j] : a real number for the binding energy of the j-th Profile[i,j] : a real number for the i-th component of the REFERENCES
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