Software,Min,Q1,Median,Q3,Max,Jobs,Nodeh,PercentUse,kWh,PercentEnergy,Users,Projects Overall,1,640.0,2048.0,6464.0,307200,620670,3469614.8,100.0,1509306.1,100.0,680,106 VASP,1,512.0,1280.0,2560.0,65536,105818,841389.2,24.3,360220.7,23.9,129,10 Unidentified,1,1536.0,3072.0,10240.0,307200,145626,408808.2,11.8,174413.6,11.6,291,81 GROMACS,1,2560.0,2560.0,4096.0,24576,50492,388950.5,11.2,192864.0,12.8,28,8 CP2K,1,384.0,1024.0,2048.0,12800,26835,278695.8,8.0,111219.9,7.4,48,10 Met Office UM,1,1280.0,6464.0,6464.0,7680,9052,213057.5,6.1,80814.8,5.4,32,5 Python,1,7680.0,16384.0,16384.0,16384,155711,173408.5,5.0,84156.8,5.6,30,20 LAMMPS,1,256.0,1024.0,4096.0,131072,13816,146784.0,4.2,61602.7,4.1,50,16 ONETEP,1,320.0,320.0,768.0,1488,3005,131901.0,3.8,49533.9,3.3,5,1 a.out,1,8192.0,8192.0,32000.0,76800,1990,126456.2,3.6,61413.7,4.1,12,10 Nektar++,128,6144.0,12288.0,12288.0,32768,434,120048.8,3.5,58568.5,3.9,7,4 iIMB,2304,7680.0,7680.0,10752.0,10752,139,86172.9,2.5,41326.6,2.7,2,1 CASTEP,4,256.0,400.0,640.0,2048,37938,83262.0,2.4,35746.9,2.4,38,6 ChemShell,64,384.0,512.0,1024.0,1920,992,48852.7,1.4,20397.7,1.4,11,3 FHI aims,1,256.0,512.0,1024.0,2560,25915,41773.1,1.2,16614.2,1.1,16,2 MITgcm,4,240.0,400.0,512.0,2000,15372,40050.0,1.2,18557.9,1.2,16,2 OpenFOAM,1,384.0,512.0,1536.0,4096,1334,35329.2,1.0,18488.0,1.2,27,11 Code_Saturne,128,4096.0,32768.0,131072.0,262144,316,31961.4,0.9,8835.6,0.6,9,5 SENGA,128,756.0,7680.0,7680.0,7680,166,28929.9,0.8,14647.1,1.0,8,2 PDNS3D,3200,3200.0,6400.0,6400.0,6400,31,24708.0,0.7,12332.5,0.8,1,1 CRYSTAL,8,512.0,1280.0,2560.0,8192,584,21641.0,0.6,8846.4,0.6,9,4 Xcompact3d,64,4096.0,4096.0,12288.0,16384,320,20035.5,0.6,8950.7,0.6,7,3 CASINO,1,1024.0,1024.0,1024.0,65536,361,19468.9,0.6,10045.5,0.7,5,3 R-matrix,16,5000.0,5000.0,12000.0,25000,15,19400.2,0.6,2062.6,0.1,1,1 GS2,512,1792.0,4608.0,8448.0,78336,377,18156.2,0.5,4470.8,0.3,3,1 OSIRIS,128,12288.0,12288.0,12288.0,12288,16,16421.1,0.5,7627.1,0.5,3,2 Quantum Espresso,2,256.0,512.0,1024.0,3072,5568,13785.2,0.4,6674.7,0.4,16,4 NEMO,1,378.0,1204.0,1204.0,17000,1777,13439.3,0.4,5774.6,0.4,17,3 Nek5000,640,2560.0,3840.0,3840.0,3840,76,12662.8,0.4,6585.8,0.4,2,2 NWChem,8,256.0,384.0,512.0,1024,10027,8361.0,0.2,3628.8,0.2,9,6 EPOCH,128,1280.0,1280.0,1280.0,1280,1254,7922.4,0.2,3912.9,0.3,2,1 SIESTA,12,960.0,960.0,1920.0,1920,2235,7276.2,0.2,921.7,0.1,6,2 NAMD,8,1600.0,1600.0,1600.0,1600,343,6735.5,0.2,2144.8,0.1,7,3 CPMD,128,128.0,384.0,384.0,1024,270,6089.1,0.2,3082.8,0.2,2,1 Cluster,512,512.0,512.0,512.0,512,583,5945.9,0.2,1850.0,0.1,1,1 RMT,4,1792.0,3072.0,6400.0,6400,485,4811.3,0.1,2276.1,0.2,6,3 HYDRA,1,2560.0,2560.0,2560.0,16384,372,3778.2,0.1,2074.1,0.1,7,5 TPLS,1,512.0,512.0,512.0,2048,103,3435.7,0.1,1829.3,0.1,4,2 3DNS,10944,50217.0,50217.0,50217.0,50217,2,3348.8,0.1,1658.5,0.1,1,1 ptau3d,48,160.0,240.0,512.0,512,123,1939.9,0.1,1006.1,0.1,1,1 FVCOM,1,512.0,512.0,512.0,896,245,1638.8,0.0,812.1,0.1,2,1 HemeLB,128,1280.0,1280.0,1280.0,6400,13,1134.5,0.0,592.3,0.0,1,1 Zacros,1,15625.0,15625.0,25600.0,25600,22,725.3,0.0,335.7,0.0,2,2 CESM,256,512.0,1176.0,1176.0,1176,19,295.3,0.0,114.7,0.0,2,1 Smilei,16,128.0,128.0,2048.0,2048,36,188.0,0.0,103.2,0.0,3,2 Arm Forge,1,8192.0,8192.0,8192.0,8192,172,159.1,0.0,52.1,0.0,16,12 HANDE,32,64.0,64.0,64.0,64,156,120.6,0.0,42.2,0.0,1,1 DL_MESO,64,128.0,128.0,128.0,128,84,62.5,0.0,29.7,0.0,2,1 WRF,72,72.0,2048.0,2048.0,2048,3,53.9,0.0,23.4,0.0,2,2 GPAW,128,128.0,128.0,128.0,768,32,42.9,0.0,22.3,0.0,2,1 CloverLeaf,128,128.0,128.0,128.0,128,3,0.2,0.0,0.1,0.0,1,1 SBLI,4,128.0,128.0,128.0,128,10,0.1,0.0,0.0,0.0,1,1 UKRmol+,1,1.0,1.0,1.0,1,2,0.0,0.0,0.0,0.0,1,1