Software,Min,Q1,Median,Q3,Max,Jobs,Nodeh,PercentUse,kWh,PercentEnergy,Users,Projects Overall,1.0,640.0,2048.0,8192.0,131072.0,4114184,3927732.7,100.0,1284420.2,100.0,706,102 VASP,2.0,512.0,1280.0,2560.0,25920.0,143268,942834.3,24.0,290665.8,22.6,110,6 Unidentified,1.0,1344.0,4096.0,8192.0,131072.0,1370058,566944.5,14.4,193781.9,15.1,322,83 a.out,1.0,16384.0,32768.0,65536.0,131072.0,474,392539.7,10.0,99116.7,7.7,10,7 GROMACS,1.0,1056.0,1056.0,4096.0,5120.0,17116,291861.1,7.4,135329.9,10.5,38,7 LAMMPS,1.0,1024.0,4608.0,102400.0,131072.0,41038,289214.3,7.4,81468.5,6.3,47,11 CP2K,1.0,320.0,1280.0,4096.0,19200.0,113087,251786.0,6.4,77817.4,6.1,50,9 CASTEP,4.0,128.0,384.0,640.0,4096.0,1073488,136636.3,3.5,46906.4,3.7,44,5 Met Office UM,1.0,576.0,6464.0,6464.0,10323.0,12707,130726.2,3.3,38766.6,3.0,38,4 Python,1.0,2304.0,16384.0,16384.0,16384.0,1276476,107532.9,2.7,31556.1,2.5,41,21 Xcompact3d,64.0,8192.0,32768.0,65536.0,65536.0,454,107243.0,2.7,40959.5,3.2,10,6 ONETEP,1.0,200.0,512.0,640.0,2048.0,1548,99636.0,2.5,33131.9,2.6,9,3 ChemShell,1.0,512.0,512.0,5120.0,9216.0,1771,93930.4,2.4,27589.5,2.1,12,3 MITgcm,4.0,624.0,624.0,900.0,1792.0,12843,73291.8,1.9,33710.8,2.6,17,4 GS2,2816.0,3712.0,8448.0,8448.0,8448.0,135,63352.3,1.6,19494.8,1.5,2,1 FHI aims,1.0,640.0,2560.0,3840.0,5120.0,4922,48765.6,1.2,14810.0,1.2,20,4 CRYSTAL,8.0,256.0,512.0,1024.0,5120.0,9408,42477.9,1.1,14576.8,1.1,6,2 NEMO,1.0,1024.0,1024.0,1808.0,8170.0,18149,35093.6,0.9,12136.1,0.9,26,3 NAMD,2.0,3200.0,3200.0,3200.0,3200.0,967,34063.4,0.9,16980.0,1.3,10,6 Nektar++,16.0,6144.0,9216.0,12288.0,12288.0,93,29071.2,0.7,11857.6,0.9,8,4 SENGA,32.0,1280.0,2500.0,3024.0,3024.0,55,25315.4,0.6,9941.6,0.8,6,2 OpenFOAM,1.0,256.0,1024.0,1280.0,12800.0,1413,24478.5,0.6,9512.3,0.7,26,14 iIMB,2304.0,3072.0,3072.0,4224.0,8192.0,73,23595.7,0.6,9493.4,0.7,2,1 Quantum Espresso,2.0,128.0,128.0,256.0,2560.0,5782,21276.2,0.5,8343.0,0.6,21,5 Smilei,2.0,8192.0,8192.0,16384.0,16384.0,50,18432.3,0.5,1375.8,0.1,2,1 SIESTA,1.0,768.0,1920.0,1920.0,1920.0,799,9759.6,0.2,625.3,0.0,9,2 CASINO,128.0,512.0,512.0,1024.0,2048.0,117,8293.1,0.2,3327.0,0.3,4,3 Nek5000,640.0,1920.0,1920.0,1920.0,2560.0,39,8237.7,0.2,3175.8,0.2,1,1 Code_Saturne,128.0,1920.0,1920.0,16384.0,16384.0,74,7331.7,0.2,2643.4,0.2,6,3 Arm Forge,1.0,6464.0,6464.0,6464.0,6464.0,68,7072.0,0.2,2519.6,0.2,11,7 RMT,128.0,2432.0,2432.0,2432.0,2944.0,167,5645.6,0.1,1840.9,0.1,3,1 EPOCH,512.0,5120.0,5120.0,5120.0,65536.0,85,5539.8,0.1,1777.2,0.1,4,1 NWChem,8.0,256.0,384.0,384.0,1024.0,2407,5435.9,0.1,1919.4,0.1,11,6 3DNS,10944.0,10944.0,10944.0,30512.0,30512.0,12,4886.2,0.1,1528.6,0.1,1,1 GPAW,32.0,256.0,256.0,512.0,768.0,466,2890.8,0.1,930.1,0.1,5,1 EDAMAME,64.0,1331.0,1331.0,1331.0,1331.0,29,2687.2,0.1,943.4,0.1,2,1 PDNS3D,20480.0,20480.0,20480.0,20480.0,20480.0,1,2683.6,0.1,1121.2,0.1,1,1 DL_POLY,8.0,128.0,128.0,256.0,384.0,220,2300.0,0.1,925.9,0.1,2,2 Cluster,512.0,512.0,512.0,512.0,512.0,85,1595.7,0.0,598.8,0.0,1,1 ptau3d,16.0,160.0,160.0,160.0,160.0,57,1494.6,0.0,568.9,0.0,1,1 WRF,72.0,2560.0,3840.0,5760.0,6400.0,37,1074.6,0.0,383.2,0.0,3,2 Amber,128.0,128.0,128.0,128.0,128.0,3840,309.5,0.0,116.0,0.0,2,2 HANDE,1.0,64.0,64.0,64.0,1280.0,109,128.4,0.0,19.6,0.0,2,2 Elk,4.0,128.0,128.0,496.0,512.0,45,113.4,0.0,71.0,0.0,2,2 FVCOM,1.0,512.0,512.0,512.0,512.0,14,68.7,0.0,24.6,0.0,2,1 HemeLB,128.0,128.0,128.0,128.0,1024.0,7,56.7,0.0,27.9,0.0,1,1 TPLS,1.0,512.0,1024.0,1024.0,1024.0,47,23.7,0.0,8.5,0.0,2,1 PRECISE,4.0,512.0,768.0,896.0,1024.0,22,4.1,0.0,0.8,0.0,1,1 CESM,128.0,256.0,256.0,768.0,768.0,7,1.5,0.0,0.6,0.0,1,1 CPMD,256.0,256.0,256.0,256.0,256.0,3,0.3,0.0,0.1,0.0,2,1 ECHAM,384.0,384.0,384.0,384.0,384.0,2,0.0,0.0,0.0,0.0,1,1 CloverLeaf,1.0,8.0,8.0,8.0,8.0,20,0.0,0.0,0.0,0.0,1,1 HYDRA,1.0,1.0,1.0,1.0,1.0,29,0.0,0.0,0.0,0.0,4,4 SBLI,1.0,1.0,1.0,1.0,1.0,1,0.0,0.0,0.0,0.0,1,1