exercises:2014_ethz_mmm:mo_ethene
Differences
This shows you the differences between two versions of the page.
Both sides previous revisionPrevious revisionNext revision | Previous revisionNext revisionBoth sides next revision | ||
exercise:mo_ethene [2014/03/28 15:01] – oschuett | exercise:2014_ethz_mmm:mo_ethene [2014/10/15 13:31] – oschuett | ||
---|---|---|---|
Line 4: | Line 4: | ||
==== 1. Step ==== | ==== 1. Step ==== | ||
Run a calculation with the following (commented) input file. \\ | Run a calculation with the following (commented) input file. \\ | ||
- | Note that the file contains explicit basis sets and potential for all-electron calculations. An explanation of the basis set formats is given here: [[exercise:basis_sets|Basis Sets]] | + | Note that the file contains explicit basis sets and potential for all-electron calculations. An explanation of the basis set formats is given here: [[basis_sets|Basis Sets]] |
<code - ethene.inp > | <code - ethene.inp > |
exercises/2014_ethz_mmm/mo_ethene.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1