Key to notation
 5      B       [He] 2s^2 2p^1

LDA LSD RLDA ScRLDA Etot = -24.344198 -24.353614 -24.347331 -24.347331 Ekin = 24.161047 24.172451 24.170449 24.169382 Ecoul = 11.503002 11.528234 11.504760 11.504547 Eenuc = -56.484587 -56.516740 -56.502555 -56.501346 Exc = -3.523660 -3.537559 -3.519985 -3.519913 1s -6.564347 -6.563384 -6.562952 -6.563041 -6.550876 2s -0.344701 -0.360441 -0.344764 -0.344768 -0.318624 2p -0.136603 -0.150853 -0.136646 -0.136568 -0.113184 -0.136524 5 B+ [He] 2s^2
LDA LSD RLDA ScRLDA Etot = -24.038275 -24.038275 -24.041449 -24.041449 Ekin = 23.877686 23.877686 23.887213 23.886081 Ecoul = 9.557870 9.557870 9.559627 9.559387 Eenuc = -54.209497 -54.209497 -54.227659 -54.226366 Exc = -3.264334 -3.264334 -3.260631 -3.260551 1s -7.044297 -7.044297 -7.042862 -7.042961 -7.044297 2s -0.713196 -0.713196 -0.713282 -0.713291 -0.713196
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