|   | Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | 
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| You are here: Home > Ions > Energy > Calculated Ionization Energy OR Calculated > Energy > Ion > Calculated Ionization Energy | |
| Cation | Neutral | Difference | Vertical | Difference | |||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| Units | Electronic Energy | VZPE | Total | Electronic Energy | VZPE | Total | Electronic Energy | VZPE | Total | Electronic Energy | Total | 
| Hartrees | -52.8116801 | -53.2261755 | 0.4144953 | 0.0000000 | 53.2261755 | ||||||
| cm-1 | 11794.4 | 13402.2 | -1607.8 | ||||||||
| eV | -1437.079 | 1.462 | -1435.617 | -1448.358 | 1.662 | -1446.696 | 11.279 | -0.199 | 11.080 | 0.000 | 1448.358 |