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Atomic Reference Data
for Electronic Structure Calculations

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32   Ge   [Ar] 3d10 4s2 4p2
Energy   LDA     LSD     RLDA     ScRLDA
Etot = -2073.807332 -2073.829860 -2094.057595 -2093.959277
Ekin = 2071.782093 2071.810411 2133.772372 2127.263869
Ecoul = 895.945638 896.161607 901.819920 901.341795
Eenuc = -4965.789424 -4966.025799 -5055.066254 -5048.045180
Exc = -75.745640 -75.776078 -74.583632 -74.519761
1s -396.292991 -396.286773
-396.284458		 -400.679718 -400.803613
2s -49.055282 -49.048574
-49.047574		 -50.187321 -50.207818
2p -43.720129 -43.713794
-43.711998		 -44.730430
-43.567264		 -43.966297
3s -5.961472 -5.955859
-5.953137		 -6.147224 -6.149280
3p -4.194822 -4.189493
-4.186209		 -4.339944
-4.182988		 -4.235425
3d -1.117316 -1.113417
-1.107268		 -1.100605
-1.079068		 -1.087994
4s -0.426523 -0.442567
-0.395513		 -0.438118 -0.438208
4p -0.149882 -0.165716
-0.120492		 -0.153561
-0.146434		 -0.148755


32   Ge+ [Ar] 3d10 4s2 4p1
Energy   LDA     LSD     RLDA     ScRLDA
Etot = -2073.525877 -2073.533337 -2093.777063 -2093.678830
Ekin = 2071.520973 2071.530367 2133.513969 2127.004816
Ecoul = 885.543646 885.590042 891.398175 890.920053
Eenuc = -4955.073535 -4955.127451 -5044.333997 -5037.312348
Exc = -75.516961 -75.526295 -74.355209 -74.291351
1s -396.629338 -396.628420
-396.626931		 -401.016606 -401.140497
2s -49.388690 -49.387396
-49.386742		 -50.521268 -50.541761
2p -44.053954 -44.052908
-44.051745		 -45.064832
-43.901617		 -44.300660
3s -6.294617 -6.293976
-6.292209		 -6.480943 -6.482999
3p -4.527944 -4.527487
-4.525355		 -4.673656
-4.516697		 -4.569137
3d -1.449573 -1.450017
-1.446063		 -1.433445
-1.411873		 -1.420815
4s -0.725841 -0.738641
-0.708866		 -0.739201 -0.739310
4p -0.422156 -0.435002
-0.404962		 -0.427705
-0.418425		 -0.421476
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