HPC Changelog

HPC Changelog

CP2K 6.1 available on Pitzer

Date: 
Monday, January 28, 2019 - 11:00am
Supercomputer: 

CP2K 6.1 has been installed on Pitzer cluster.  For information on available executables and installation details see the software page for CP2K.

ORCA 4.0.1.2 and 4.1.0 available

Date: 
Thursday, January 24, 2019 - 1:00pm
Supercomputer: 

ORCA 4.0.1.2 and 4.1.0 have been installed on Owens and Pitzer clusters.  For information on available executables and installation details see the software page for ORCA.

NBO 6.0 now available on Owens

Date: 
Friday, November 2, 2018 - 12:00pm
Supercomputer: 

NBO 6.0 has been installed on the Owens cluster; usage is via the module nbo/6.0. For information on available executables and installation details see the software page for NBO.

Rosetta 3.10 now available

Date: 
Thursday, November 1, 2018 - 12:15pm
Supercomputer: 

 

Rosetta 3.10 has been installed on the Owens and Pitzer clusters; usage is via the module rosetta/3.10. For information on available executables and installation details see the software page for Rosetta.

Desmond 2018.2 available on Owens

Date: 
Monday, October 29, 2018 - 12:30pm
Supercomputer: 

Desmond  2018.2 has been installed on the Owens clusters; usage is via the module desmond/2018.2. For information on available executables and installation details see the software page for Desmond.

COMSOL 5.4 available on Owens

Date: 
Monday, October 22, 2018 - 11:45am
Supercomputer: 

COMSOL 5.4 has been installed on Owens; usage is via the module comsol/5.4.

Quantum Espresso 6.3 available on Owens

Date: 
Thursday, October 18, 2018 - 3:15pm
Supercomputer: 

Quantum Espresso 6.3 has been installed on Owens; usage is via the module espresso/6.3. For information on available executables and installation details see the software page for Quantum Espresso or the output of the respective module help command, e.g.: module help espresso/6.3.  Note that packages WEST were not installed because they are not available with 6.3.

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