technicalspecifications

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technicalspecifications [2021/11/10 15:59] – created docuadmintechnicalspecifications [2025/06/12 13:18] (current) – [Software] docuadmin
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 +====== Master Node ======
 +
 +  * 2 Intel Xeon E5-2640v4 (2.4GHz 10core)
 +  * 64GB RAM
 +  * 2 2TB 7200RPM, RAID1
 +  * Gigabit Ethernet
 +  * Infiniband
 +
 +====== Storage Node ======
 +
 +  * 2 Intel Xeon E5-2650v4 (2.2GHz 12core)
 +  * 64GB RAM
 +  * 2 480GB SSDs (sdb and sdc, RAID, / and /boot)
 +  * 12 4TB 7200RPM, (logical volume group vg-data, /data, RAID6)
 +  * Gigbit Ethernet
 +  * Inifiband
 +
 +====== Compute Nodes (12) ======
 +  * 10 nodes:
 +    * 2 Intel Xeon E5-2640v4 (2.4GHz 10core)
 +    * 64GB RAM
 +    * 64GB SATA DOM (local filesystem)
 +  * 2 nodes:
 +    * 2 Intel Xeon Cascade Lake Gold 5215 (2.5GHz 10core)
 +    * 128GB RAM
 +    * 64GB SATA DOM (local filesystem)
 +====== Gigabit Ethernet Switch ======
 +
 +  * Cisco 2960X
 +
 +====== Infiniband Switch ======
 +
 +  * Mellanox SwitchX-2 
 +  
 +====== Software ======
 +
 +  * Scheduler:
 +      * SLURM: 
 +        * version 22.05.09
 +        * SLURM Documentation (https://slurm.schedmd.com/archive/slurm-22.05.9/
 +  
 +  * Open OnDemand:
 +      * Build and run jobs, access a shell or an interactive session in your browser
 +      * Documentation (https://openondemand.org/)
 +      * Access Grinnell's Cluster (https://hpc.grinnell.edu)
 +  
 +  * MPI:
 +      * OpenMPI:
 +        * version 1.8.8gcc
 +
 +  * Chemistry:
 +      * WebMO (http://hpc.grinnell.edu/~webmo/cgi-bin/webmo/login.cgi)
 +        * Application directory: /data/home/webmo/webmo
 +        * Globals config file: /data/home/webmo/webmo/globals.ini
 +      * Gaussian 09 (http://gaussian.com)
 +        * Application directory: /usr/local/gaussian
 +      * NBO6
 +        * Application directory: /usr/local/nbo6
 +        * Symbolic link: /usr/local/gaunbo6 -> /usr/local/nbo6/bin/gaunbo6
 +      * GROMACS
 +        * Load with `module load gromacs2023.2`
 +        * Application directory: /usr/local/gromacs
 +  * Physics:
 +      * Charm++