Magnesium (V, 1s frozen)
 
BASIS
1S  10.00

2S   2.70
2S   4.35
2P   2.35
2P   3.90
2P   7.10
3S   0.75
3S   1.10
3S   1.75
3P   1.75
3P   0.90

3D   1.50
4F   1.6
END
 
CORE    1  0  0  0
 1S        10.5500
 1S        14.6500
 2S         2.9000
 2S         4.4000
 3S         1.1000
 3S         0.7500
 3S         1.7000
END
 
DESCRIPTION
    .74244066469460734403E+00   .26429239203000493008E+00
   -.49405551943441259818E-02   .53304398297620023475E-02
   -.26837961362488117235E-02   .10627377957177009445E-02
    .30097083576436042297E-02

0/
END
 
FIT
 1S  20.90
 2S  21.74
 2S  13.88
 3S  13.05
 3S   8.93
 4S   8.10
 4S   5.80
 4S   4.15
 5S   3.71
 5S   2.74
 5S   2.03
 5S   1.50
 2P  17.55
 3P  13.86
 3P   8.08
 4P   6.31
 4P   3.93
 5P   3.07
 5P   2.00
 3D  14.20
 3D   8.24
 4D   6.40
 4D   3.96
 5D   3.08
 5D   2.00
 4F   5.00
 4F   3.00
 5G   3.50
 END
 
FITCOEFFICIENTS
 -0.3610508E-03  0.3510774E-01 -0.4004042E-01  0.8287677E+00 -0.2588745E+01
  0.1229242E+03  0.4355677E+03  0.1284477E+04 -0.2641401E+03  0.9029065E+02
  0.6818224E+02
/
END