exercises:2014_ethz_mmm:hfx_h2ion
Differences
This shows you the differences between two versions of the page.
| Both sides previous revisionPrevious revision | Next revisionBoth sides next revision | ||
| exercise:hfx_h2ion [2014/04/10 15:32] – oschuett | exercise:hfx_h2ion [2014/04/11 12:54] – sclelia | ||
|---|---|---|---|
| Line 6: | Line 6: | ||
| * 50% HF exchange, 50% PBE exchange | * 50% HF exchange, 50% PBE exchange | ||
| * 100% HF exchange, 0% PBE exchange | * 100% HF exchange, 0% PBE exchange | ||
| + | |||
| + | ===== Questions ===== | ||
| + | * Report the dissociation curve for the $H^+_2$ ion, for the three fractions of Hartree-Fock exchange employed. | ||
| ===== Required Files ===== | ===== Required Files ===== | ||
exercises/2014_ethz_mmm/hfx_h2ion.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1