Software,Min,Q1,Median,Q3,Max,Jobs,Nodeh,PercentUse,kWh,PercentEnergy
Overall,1,768.0,2560.0,8192.0,131072,1119209,3761708.8,100.0,1612040.5,100.0
Unidentified,1,1344.0,6144.0,16000.0,87808,411711,767708.1,20.4,275312.0,17.1
VASP,1,512.0,1280.0,4096.0,55296,67667,704750.5,18.7,309502.7,19.2
Nektar++,8,16384.0,32768.0,38400.0,65536,1929,310228.0,8.2,140580.8,8.7
GROMACS,1,1024.0,2560.0,2560.0,5120,43679,268530.0,7.1,135415.1,8.4
Met Office UM,1,896.0,1280.0,6464.0,7680,38294,255581.8,6.8,97248.7,6.0
CP2K,1,320.0,640.0,1024.0,16384,26894,228548.2,6.1,101190.0,6.3
NEMO,1,5424.0,7910.0,9600.0,10112,57927,133462.7,3.5,60253.6,3.7
iIMB,2880,7680.0,8192.0,8192.0,10752,137,128209.9,3.4,64176.2,4.0
CASTEP,4,384.0,640.0,2560.0,5760,33571,127534.2,3.4,48388.3,3.0
MITgcm,4,1200.0,1200.0,1200.0,3968,10555,122620.5,3.3,52068.6,3.2
Python,1,2048.0,2560.0,7680.0,8192,359444,87748.8,2.3,39175.5,2.4
LAMMPS,1,256.0,512.0,640.0,131072,21107,76390.0,2.0,33512.6,2.1
ONETEP,64,320.0,480.0,480.0,1600,686,59508.7,1.6,27777.9,1.7
PDNS3D,3200,3200.0,3200.0,6400.0,16000,47,56298.4,1.5,30909.2,1.9
GS2,32,2112.0,4608.0,8448.0,8448,892,51963.7,1.4,16161.7,1.0
SENGA,64,5760.0,5760.0,5760.0,5760,92,41197.5,1.1,22411.0,1.4
FHI aims,1,1280.0,2048.0,2048.0,5120,2835,41138.1,1.1,18906.7,1.2
EPOCH,128,1280.0,1920.0,5120.0,16384,4756,40890.5,1.1,20067.2,1.2
CASINO,128,512.0,512.0,1024.0,1024,410,31563.7,0.8,16316.1,1.0
OpenFOAM,1,256.0,420.0,1024.0,16384,6724,31370.2,0.8,15817.4,1.0
ChemShell,1,320.0,384.0,1024.0,1536,550,29605.3,0.8,12026.5,0.7
Xcompact3d,1,2048.0,2048.0,3072.0,131072,1107,21856.9,0.6,11204.8,0.7
3DNS,30512,30512.0,50217.0,50217.0,50217,26,21724.0,0.6,11378.7,0.7
Nek5000,1024,1280.0,1280.0,2560.0,4096,54,16235.3,0.4,8681.8,0.5
a.out,1,1024.0,2048.0,8192.0,33483,750,13925.8,0.4,7071.8,0.4
CRYSTAL,4,512.0,32768.0,65536.0,65536,263,12897.5,0.3,4410.9,0.3
RMT,4,1792.0,3456.0,10112.0,12800,407,10986.0,0.3,5257.9,0.3
NAMD,128,512.0,512.0,640.0,3200,1454,10976.7,0.3,5512.3,0.3
Code_Saturne,1,1024.0,3072.0,3072.0,16384,114,8692.0,0.2,4281.0,0.3
NWChem,32,168.0,256.0,512.0,768,9431,8059.5,0.2,3399.6,0.2
GPAW,16,128.0,256.0,256.0,768,740,7932.5,0.2,2478.5,0.2
Quantum Espresso,1,192.0,1536.0,1536.0,3456,4995,7714.3,0.2,3383.3,0.2
HANDE,1,320.0,640.0,640.0,640,71,7453.6,0.2,1601.3,0.1
CPMD,128,128.0,256.0,256.0,768,602,7261.0,0.2,3758.4,0.2
AxiSEM3D,128,3072.0,3072.0,4096.0,6144,23,4339.9,0.1,973.1,0.1
SIESTA,1,1280.0,1280.0,1280.0,1280,51,3504.0,0.1,411.8,0.0
HYDRA,1,65536.0,65536.0,65536.0,65536,5171,1354.8,0.0,156.3,0.0
WRF,64,1024.0,1024.0,1024.0,1280,215,835.0,0.0,457.9,0.0
Smilei,128,1920.0,1920.0,1920.0,5760,3037,614.2,0.0,180.2,0.0
TPLS,128,128.0,512.0,512.0,512,20,140.9,0.0,70.1,0.0
Zacros,1,400.0,400.0,625.0,625,178,123.7,0.0,60.5,0.0
DL_POLY,1280,1280.0,1280.0,1280.0,1280,1,100.0,0.0,41.6,0.0
Arm Forge,1,256.0,512.0,4096.0,8192,131,66.5,0.0,22.0,0.0
OSIRIS,512,512.0,512.0,512.0,512,39,24.4,0.0,11.4,0.0
CESM,384,1175.0,1175.0,1176.0,1536,7,20.9,0.0,5.9,0.0
HemeLB,128,128.0,128.0,128.0,128,6,9.8,0.0,5.1,0.0
Amber,128,128.0,128.0,128.0,128,185,9.1,0.0,4.7,0.0
ptau3d,16,16.0,16.0,16.0,16,25,1.4,0.0,1.4,0.0
CloverLeaf,1,128.0,128.0,128.0,128,34,0.2,0.0,0.1,0.0
UKRmol+,1,1.0,1.0,1.0,2,158,0.1,0.0,0.0,0.0
Elk,4,4.0,4.0,4.0,16,4,0.0,0.0,0.0,0.0
FVCOM,1,1.0,1.0,2.0,2,3,0.0,0.0,0.0,0.0