Software,Min,Q1,Median,Q3,Max,Jobs,Nodeh,PercentUse Overall,1,512.0,2304.0,8192.0,524288,1587433,3581808.0,100.0 Unidentified,1,1280.0,10000.0,34560.0,327680,187723,925327.4,25.8 VASP,1,512.0,2048.0,3840.0,52224,131918,836738.7,23.4 CP2K,1,256.0,640.0,4096.0,32768,18712,219201.1,6.1 GROMACS,1,384.0,1056.0,2560.0,10240,62281,182653.3,5.1 CASTEP,5,256.0,1024.0,2624.0,7680,927351,172113.6,4.8 Code_Saturne,2,8960.0,32768.0,32768.0,524288,416,134909.9,3.8 LAMMPS,1,512.0,1024.0,3072.0,131072,12716,133164.0,3.7 NEMO,1,5760.0,7910.0,9984.0,9984,2741,78737.5,2.2 SENGA,480,3840.0,5760.0,7680.0,7680,114,74824.8,2.1 ChemShell,1,336.0,1280.0,1536.0,5120,890,74526.7,2.1 Met Office UM,48,384.0,6464.0,6464.0,6464,10052,65897.5,1.8 iIMB,3072,7680.0,7680.0,7680.0,7680,63,56574.2,1.6 Xcompact3d,8,8192.0,8192.0,16384.0,524288,484,53967.8,1.5 Python,1,2000.0,2048.0,7680.0,16384,130462,50176.4,1.4 ONETEP,1,256.0,512.0,1024.0,1536,3421,49476.7,1.4 OpenFOAM,1,512.0,1024.0,1536.0,6400,3296,40771.1,1.1 SIESTA,1,480.0,480.0,640.0,1280,369,39419.4,1.1 CRYSTAL,128,512.0,512.0,512.0,32768,872,39221.8,1.1 CASINO,128,2048.0,2560.0,16384.0,32768,257,39090.7,1.1 PDNS3D,3200,32000.0,64000.0,64000.0,64000,8,36421.2,1.0 Nek5000,640,1280.0,1280.0,2560.0,4096,113,32722.8,0.9 FHI aims,1,256.0,1024.0,1152.0,16384,6154,32425.7,0.9 CPMD,256,256.0,768.0,768.0,1024,554,28281.8,0.8 Nektar++,1,4096.0,6144.0,6144.0,8192,336,25905.9,0.7 EPOCH,10,3840.0,3840.0,3840.0,8192,463,23270.2,0.6 RMT,1,2432.0,2432.0,2432.0,14464,864,20570.0,0.6 GPAW,32,128.0,128.0,128.0,2048,40136,17551.1,0.5 a.out,1,512.0,1024.0,2048.0,16384,1251,15458.0,0.4 Quantum Espresso,1,256.0,640.0,1024.0,2048,14339,14477.8,0.4 3DNS,10944,10944.0,30512.0,30512.0,30512,61,13816.7,0.4 MITgcm,8,160.0,252.0,378.0,2000,9418,11154.2,0.3 GS2,128,512.0,512.0,512.0,2400,827,8855.9,0.2 NWChem,2,512.0,512.0,512.0,4096,11042,8408.8,0.2 NAMD,8,512.0,1600.0,1600.0,1600,1232,8117.9,0.2 ptau3d,32,256.0,256.0,256.0,512,81,5322.9,0.1 HANDE,1,1.0,1280.0,1280.0,1280,4815,2746.5,0.1 HYDRA,1,2560.0,2560.0,16384.0,32768,182,1904.3,0.1 TPLS,1,512.0,512.0,512.0,2048,132,1902.4,0.1 HemeLB,128,768.0,768.0,2048.0,4096,21,1819.2,0.1 Smilei,1,128.0,4096.0,4096.0,16384,43,1345.2,0.0 CESM,512,512.0,512.0,512.0,2048,338,757.1,0.0 DL_MESO,64,4096.0,16384.0,16384.0,16384,146,669.5,0.0 FVCOM,1,512.0,512.0,512.0,512,70,403.1,0.0 SBLI,512,4096.0,4096.0,4096.0,4096,4,371.8,0.0 AxiSEM3D,8,1024.0,1024.0,1024.0,1024,2,285.6,0.0 WRF,32,32.0,32.0,72.0,256,16,41.4,0.0 DL_POLY,8,128.0,128.0,128.0,128,5,7.3,0.0 Amber,100,100.0,100.0,100.0,100,387,0.6,0.0 OSIRIS,8,16.0,16.0,16.0,64,12,0.4,0.0 CloverLeaf,1,1.0,1.0,1.0,16,129,0.1,0.0 UKRmol+,1,2.0,2.0,2.0,8,113,0.0,0.0 ECHAM,384,384.0,384.0,384.0,384,1,0.0,0.0