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Revision as of 17:50, 25 March 2020 by Rzepa (Talk | contribs) (Configuring the Imperial College HPC Resource to run Gaussian Calculations using an ELN)

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Configuring the Imperial College HPC Resource to run Gaussian Calculations using an ELN

  1. Screenshot 103.jpg
    Go to https://portal.hpc.imperial.ac.uk and login using your college user name and password
  2. Screenshot 104.jpg
    Select Pools and complete the section New Pools as shown (queue name of your choice, Host = login.cx1.hpc.ic.ac.uk and path = /apps/scan-scripts/pqchem and click Add
  3. Screenshot 105.jpg
    You should get Pool added successfully and the instructions shown.
  4. To complete the next step you will have to install an sftp client. The below is appropriate for Windows 10 (for which you have admin rights to install programs).
    1. An example of an sftp client is WInSCP, which can be downloaded from https://winscp.net/eng/download.php