{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "C" "C" "C" "C" ] } "a" { "source-value" [ 4.09814 3.823549 3.653368 3.529723 3.432553 3.352495 3.284416 3.225194 3.172786 3.125785 3.083179 3.044216 3.008322 2.975048 2.944038 2.915003 2.887707 2.861953 2.837576 2.814436 2.792414 2.771407 2.751325 2.73209 2.718995 2.705214 2.690669 2.675273 2.658917 2.641475 2.622793 2.602681 2.5809 2.55715 2.531037 2.502041 2.469443 2.432221 2.388843 2.33686 2.271992 2.18567 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.09814e-10 3.823549e-10 3.653368e-10 3.5297230000000003e-10 3.432553e-10 3.352495e-10 3.284416e-10 3.225194e-10 3.172786e-10 3.125785e-10 3.083179e-10 3.044216e-10 3.008322e-10 2.9750480000000004e-10 2.944038e-10 2.915003e-10 2.887707e-10 2.861953e-10 2.837576e-10 2.814436e-10 2.792414e-10 2.771407e-10 2.7513250000000003e-10 2.73209e-10 2.718995e-10 2.705214e-10 2.6906690000000003e-10 2.6752729999999997e-10 2.658917e-10 2.641475e-10 2.6227930000000003e-10 2.6026810000000004e-10 2.5809000000000004e-10 2.5571500000000003e-10 2.5310370000000003e-10 2.5020410000000004e-10 2.469443e-10 2.432221e-10 2.3888430000000003e-10 2.33686e-10 2.271992e-10 2.18567e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ -0.551499 0.026982 0.500102 0.798962 1.11924 1.50037 1.87241 2.14126 2.29564 2.38813 2.50411 2.70909 3.00806 3.34514 3.65783 3.91502 4.11145 4.257 4.36533 4.44675 4.50732 4.54978 4.57515 4.58367 4.5793 4.56425 4.53485 4.48741 4.42253 4.35213 4.29802 4.26994 4.2298 4.0776 3.92206 3.89374 3.89461 3.88103 3.81217 3.58355 2.93061 2.45377 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ -8.835988041945792e-20 4.32299295824256e-21 8.012517324153217e-20 1.2800782373076097e-19 1.7932201610641921e-19 2.403857736549696e-19 2.999931526552128e-19 3.430676711054208e-19 3.6780207377733126e-19 3.826206053431104e-19 4.012026497911488e-19 4.340440661643073e-19 4.819443405963648e-19 5.359505101302912e-19 5.860489708860865e-19 6.272553513964417e-19 6.58726906758816e-19 6.8204658747456e-19 6.994029668076865e-19 7.1244788885424e-19 7.221522726464256e-19 7.289551145783425e-19 7.33019836665312e-19 7.343848911462336e-19 7.33684739962944e-19 7.312734641486401e-19 7.26563064883488e-19 7.189623389944128e-19 7.0856741707866245e-19 6.972880936682304e-19 6.886187159730816e-19 6.841198040218753e-19 6.77688667065984e-19 6.533035388974081e-19 6.283832837374849e-19 6.238459195473792e-19 6.239853089133889e-19 6.218095530623425e-19 6.107769648515136e-19 5.74148002946784e-19 4.695354826682689e-19 3.931372926820416e-19 ] } }