| Affiliation |
access-ci.org
|
| Resource Group |
Software
|
| Type |
Executable Software
|
| Name |
orca
|
| Short Description |
orca version 5.0.1 on PSC Bridges-2 Regular Memory (Bridges-2 RM)
|
| Description |
<div class="document">
<p>ORCA v 5.0.1 Ab initio Molecular Dynamics There is an example job script in /opt/packages/examples/orca version orca_5_0_1_linux_x86-64_shared_openmpi411</p>
<p>Available on PSC Bridges-2 Regular Memory (Bridges-2 RM) (bridges2-rm.psc.access-ci.org)</p>
<dl class="docutils">
<dt>Access from a shell using the command:</dt>
<dd>module load orca/5.0.1</dd>
</dl>
</div>
|
| Topics |
Molecular Dynamics
|
| Keywords |
None
|
| Quality Level |
Production
|
| ProviderID |
urn:ogf.org:glue2:access-ci.org:resource:cider:infrastructure.organizations:848
|
| Local ID |
urn:ogf.org:glue2:access-ci.org:ApplicationHandle:module:5.0.1.orca.bridges2-rm.psc.access-ci.org.d01e90a4ce26ecb8c17b56785ae4b320
|
| Global ID |
urn:ogf.org:glue2:access-ci.org:ApplicationHandle:module:5.0.1.orca.bridges2-rm.psc.access-ci.org.d01e90a4ce26ecb8c17b56785ae4b320
|
| Validity |
|
| Creation Time |
|
