Neodymium (IV, 4d frozen)
 
BASIS
1S   40.000
2S   25.750
3S   13.850
4S    8.550
2P   28.200
3P   13.250
4P    8.350
3D   15.150
4D    7.550

        1S  117.000
5S    4.500
5S    2.950
6S    2.000
6S    1.300
6S     .870
5P    3.850
5P    2.350
5D    2.950
5D    1.600
5D     .890
4F    8.900
4F    4.200
4F    1.850
6P    1.300
END
 
CORE    4  3  2  0
        1S  463.000
        1S  117.000
        1S   62.300
        2S   69.700
        2S   27.000
        3S   22.000
        3S   14.250
        4S    9.500
        4S    6.750
        5S    4.500
        5S    2.950
        6S    2.000
        6S    1.300
        6S     .870
        2P   42.250
        2P   26.000
        3P   15.150
        3P   11.600
        4P    8.750
        4P    6.000
        5P    3.850
        5P    2.350
        3D   19.750
        3D   12.100
        4D    8.000
        4D    4.900
        5D    2.950
        5D    1.600
        5D     .890
END
 
DESCRIPTION
    .13371732121343458607E-01   .92672488661097660034E-01
    .92563667440108943207E+00  -.13057022931551077322E-01
    .25847722799007561562E-02  -.25650508530872823815E-02
    .17008438682391345109E-02  -.11916640503373510888E-02
    .86050899784453926435E-03  -.38517417609376447063E-03
    .23506440573982324751E-03  -.12120313653583573619E-03
    .73973104232768837436E-04  -.27623969816686786078E-04

   -.40774269083323801122E-02  -.67027673754539274231E-01
   -.21956097657086692809E+00  -.16649271084215472305E+00
    .11108552934672526469E+01   .16830258843770335569E-01
   -.13520334379870409605E-01   .12657782370257360596E-01
   -.97694297288831010578E-02   .46234186918800556504E-02
   -.28811813458322304941E-02   .15051969197725433795E-02
   -.92370082834665402823E-03   .34582730543009977155E-03

    .15864708348100229566E-02   .51740939583217633591E-01
    .48036109850735642102E-01   .13531854450741392926E+00
   -.65550231903875300077E+00  -.11061577433868290121E+00
    .12874635165582273277E+01  -.99999370926903100032E-01
    .81342741603610491108E-01  -.38345732651179284534E-01
    .23965816802404980163E-01  -.12593857610974227776E-01
    .77600372814341988734E-02  -.29125962433506728810E-02

   -.79115505234497848688E-03  -.23446295993911035749E-01
   -.26790980418638459665E-01  -.62368568296657850292E-01
    .31842296848832390976E+00   .15721097155207094942E+00
   -.99814890589315297120E+00   .79806557300594449522E+00
    .51949124793850864901E+00   .14099956020983742816E-01
   -.82552490136721928121E-02   .47460727824169338107E-02
   -.30620828961802019214E-02   .11768821437801568058E-02

    .19810269545219369447E+00   .82310835125718817551E+00
    .61498674348922366395E-02  -.84064361548770432514E-02
    .63762237006702842529E-02  -.36932071039254485423E-02
    .12030389588805001991E-02  -.44067139026702552024E-03

   -.68990866789056054520E-01  -.47696928490995049721E+00
    .81180862717608770485E+00   .35650612814227322644E+00
   -.20635920273352297699E-01   .10536619092955626376E-01
   -.33048871040912341721E-02   .12110686853140314751E-02

    .27960721706261109504E-01   .23956724340891324965E+00
   -.43289221600353033903E+00  -.34956931296206111837E+00
    .82897739600026099094E+00   .45027397909215277627E+00
    .82380956903057508955E-02  -.24433600616996717370E-02

    .40101113865537013625E+00   .64897264072358284981E+00
   -.64191790720135640663E-02   .49643543964810873600E-02
   -.16621264852446104333E-02   .78259670880164713611E-03
   -.29284950914235357688E-03

   -.19708464802601047272E+00  -.29086142992828445397E+00
    .71294396594574926951E+00   .45452744655607313362E+00
   -.68858924907528001706E-03   .23018778318011829699E-02
   -.93757784684395963342E-03

0/
END
 
FIT
 1S  80.00
 1S  49.51
 2S  56.65
 2S  39.09
 3S  39.54
 3S  28.91
 4S  27.91
 4S  21.18
 5S  19.99
 5S  15.58
 6S  14.53
 6S  11.55
 7S  10.70
 7S   8.64
 8S   7.97
 8S   6.52
 9S   6.00
 9S   4.96
10S   4.56
10S   3.81
10S   3.18
11S   2.92
11S   2.46
11S   2.07
11S   1.74
 2P  68.20
 3P  57.44
 4P  47.43
 5P  38.97
 5P  26.60
 6P  21.87
 6P  15.39
 7P  12.69
 7P   9.15
 8P   7.57
 8P   5.57
 9P   4.63
 9P   3.46
10P   2.89
10P   2.19
 3D  56.40
 4D  41.52
 5D  30.79
 6D  23.05
 7D  17.43
 7D  11.56
 8D   8.82
 8D   6.00
 9D   4.62
 9D   3.21
10D   2.49
10D   1.76
 4F  44.20
 5F  29.35
 6F  19.87
 7F  13.69
 8F   9.57
 8F   5.98
 9F   4.24
 9F   2.72
 5G  32.40
 6G  17.50
 7G   9.79
 8G   5.63
 9G   3.32
 9G   1.78
END
 
FITCOEFFICIENTS
   .183832221498113419E+02  -.905349236741457908E+01  -.114415533813957654E+04
   .966376727754123067E+03  -.835370737019857916E+04   .244180895498995412E+02
  -.104761582925609237E+05   .999805617500922563E+04  -.402564394483961732E+05
   .566486699769224560E+04   .106948862570061319E+05   .200773855812204147E+04
   .402984943595175423E+03   .246276112874990559E+03   .166737487017396575E+03
   .281481353663557199E+01   .157793526394219752E+01  -.101930128677812801E+00
   .380762288468397825E-01   .362241016856186884E-02   .129358730624851994E-02
   .650923566035862389E-04   .105638352079823650E-04   .144727379245349176E-06
   .599235262635687265E-08
/
END