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Updated Tutorial (markdown)

Thomas Applencourt 2016-01-08 17:34:38 +01:00
parent a328749924
commit 7f5c55d081

@ -48,8 +48,9 @@ You can see a review of the EZFIO file & all the option available for all the bi
#Run the SCF and Full-CI calculations
First, create the canonical MOs by running an SCF calculation::
```
qp_run SCF hcn.ezfio
```
The expected SCF energy is -92.8832967.