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Atomic Reference Data |
Radon |
Key to notation ASCII text |
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| 86 Rn [Xe] 4f14 5d10 6s2 6p6 | ||||
| Energy | LDA | LSD | RLDA | ScRLDA |
|---|---|---|---|---|
| Etot = | -21861.346869 | -21861.346869 | -23556.323085 | -23492.950469 |
| Ekin = | 21854.672700 | 21854.672700 | 27839.562791 | 26852.806124 |
| Ecoul = | 8632.016039 | 8632.016039 | 8980.890066 | 8938.051530 |
| Eenuc = | -51966.120382 | -51966.120382 | -60018.170941 | -58926.599137 |
| Exc = | -381.915225 | -381.915225 | -358.605001 | -357.208986 |
| 1s | -3204.756288 | -3204.756288 -3204.756288 |
-3590.911234 | -3598.855827 |
| 2s | -546.577960 | -546.577960 -546.577960 |
-653.943650 | -655.954489 |
| 2p | -527.533025 | -527.533025 -527.533025 |
-629.384272 -529.745459 |
-557.005834 |
| 3s | -133.369144 | -133.369144 -133.369144 |
-160.451783 | -160.979050 |
| 3p | -124.172862 | -124.172862 -124.172862 |
-149.290847 -126.726749 |
-132.962557 |
| 3d | -106.945006 | -106.945006 -106.945006 |
-108.610708 -103.858731 |
-106.090128 |
| 4s | -31.230804 | -31.230804 -31.230804 |
-38.215793 | -38.353106 |
| 4p | -27.108985 | -27.108985 -27.108985 |
-33.292086 -27.607283 |
-29.165132 |
| 4d | -19.449994 | -19.449994 -19.449994 |
-19.630351 -18.565610 |
-19.059234 |
| 4f | -8.953318 | -8.953318 -8.953318 |
-8.102001 -7.843506 |
-7.995594 |
| 5s | -5.889683 | -5.889683 -5.889683 |
-7.349489 | -7.383977 |
| 5p | -4.408702 | -4.408702 -4.408702 |
-5.558376 -4.359837 |
-4.687307 |
| 5d | -1.911329 | -1.911329 -1.911329 |
-1.793818 -1.631236 |
-1.708347 |
| 6s | -0.626570 | -0.626570 -0.626570 |
-0.804950 | -0.811281 |
| 6p | -0.293180 | -0.293180 -0.293180 |
-0.387498 -0.255692 |
-0.289891 |
| 86 Rn+ [Xe] 4f14 5d10 6s2 6p5 | ||||
| Energy | LDA | LSD | RLDA | ScRLDA |
| Etot = | -21860.907539 | -21860.912366 | -23555.874800 | -23492.511884 |
| Ekin = | 21854.258445 | 21854.264276 | 27839.097311 | 26852.394903 |
| Ecoul = | 8603.092915 | 8603.130249 | 8951.318617 | 8908.538753 |
| Eenuc = | -51936.651861 | -51936.694235 | -59987.996223 | -58896.546636 |
| Exc = | -381.607039 | -381.612655 | -358.294505 | -356.898904 |
| 1s | -3205.099250 | -3205.099181 -3205.098338 |
-3591.262329 | -3599.205691 |
| 2s | -546.919858 | -546.919586 -546.919164 |
-654.293231 | -656.303179 |
| 2p | -527.875083 | -527.874920 -527.874276 |
-629.734142 -530.095111 |
-557.354648 |
| 3s | -133.710589 | -133.710381 -133.709849 |
-160.800822 | -161.327271 |
| 3p | -124.514348 | -124.514178 -124.513571 |
-149.639944 -127.075780 |
-133.310788 |
| 3d | -107.286516 | -107.286323 -107.285757 |
-108.959739 -104.207744 |
-106.438335 |
| 4s | -31.571779 | -31.571784 -31.570847 |
-38.564411 | -38.700933 |
| 4p | -27.449958 | -27.449988 -27.449002 |
-33.640710 -27.955826 |
-29.512910 |
| 4d | -19.790948 | -19.790996 -19.789974 |
-19.978867 -18.914099 |
-19.406950 |
| 4f | -9.294243 | -9.294310 -9.293252 |
-8.450449 -8.191939 |
-8.343254 |
| 5s | -6.228898 | -6.229753 -6.227190 |
-7.696701 | -7.730454 |
| 5p | -4.747644 | -4.748647 -4.745792 |
-5.905405 -4.706453 |
-5.033342 |
| 5d | -2.249004 | -2.250891 -2.246258 |
-2.138982 -1.976010 |
-2.052722 |
| 6s | -0.940318 | -0.949459 -0.929994 |
-1.132076 | -1.138746 |
| 6p | -0.590587 | -0.599678 -0.580343 |
-0.700457 -0.553814 |
-0.593265 |
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