Commit 52bdccc8 authored by Jan Siwiec's avatar Jan Siwiec
Browse files

edited installed version section, related to #68

parent 9b97e542
......@@ -4,17 +4,12 @@
ORCA is a flexible, efficient, and easy-to-use general-purpose tool for quantum chemistry with specific emphasis on spectroscopic properties of open-shell molecules. It features a wide variety of standard quantum chemical methods ranging from semiempirical methods to DFT to single- and multireference correlated ab initio methods. It can also treat environmental and relativistic effects.
## ORCA Available on the Cluster
## Installed Versions
Many versions of ORCA are available on our clusters. You can list all versions by the `ml av` command:
For the current list of installed versions, use:
```console
$ ml av orca
-------------------------- /apps/modules/chem --------------------------
ORCA/4_0_0-linux_x86-64 ORCA/4_0_1-linux_x86-64 ORCA/4.0.1.2 (D)
Where:
D: Default Module
```
## Serial Computation With ORCA
......
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