| ARCHIE Project title: | 2 TB (very rough estimate) |
| Project PI: | Royal College Building, room 413 204 George Street |
| Department: | 01/10/2013 |
| Address: | Royal College Building, room 413, 204 George Street, open-source software, G1 1XW |
| Relevant industrial collaborations: | |
| Existing relevant KTP activities: | |
| Does the PI require to run calculations? | 1 |
| Number of users involved in the project: | 30/09/2016 |
| User 1 details: |
Ms Alessia Centi |
| Service level requested: | |
| ARCHIE Project description: | 2 TB (very rough estimate) |
| Potential output of the project: |
Publications in international journals – 4 papers expected in journals like J. Phys. Chem., Langmuir, JACS. |
| Project start date: | 01/10/2013 |
| Duration of the project: | 30/09/2016 |
| Total CPU time required (in hours): | 100000 (estimate) |
| CPU hours required by typical job: | 1 |
| Approximate amount of data created per job (in GB): | |
| Approximate amount of data created per project: | 2 TB (very rough estimate) |
| Funding Agency Grant Reference No: | |
| pFact ID: | |
| RKES ID: | |
| Software required for the project: | open-source software |
| Software required to be installed for the project: | GROMACS (www.gromacs.org) |
| Experience in using software package 1: | |
| Software required to be installed for the project: | |
| Experience in using software package 2: | 1 |
| Software required to be installed for the project: | |
| Experience in using software package 3: | 1 |
| Training required: | Basic Linux, Basic of using HPC, Visualisation in VMD, Scripting languages |
| Other training required: | |
| Experience in using HPC: | 4 |