{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Cu" "Cu" ] } "a" { "source-value" [ 4.39779 4.103122 3.920498 3.787813 3.683538 3.597627 3.52457 3.461017 3.404777 3.35434 3.308619 3.266808 3.228289 3.192582 3.159305 3.128147 3.098855 3.071218 3.045058 3.020227 2.996595 2.974051 2.952501 2.93186 2.917808 2.903019 2.887411 2.870888 2.853337 2.83462 2.814572 2.792989 2.769616 2.744129 2.716108 2.684992 2.650011 2.610067 2.563517 2.507734 2.438123 2.34549 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.39779e-10 4.1031220000000003e-10 3.920498e-10 3.787813e-10 3.683538e-10 3.5976270000000004e-10 3.52457e-10 3.461017e-10 3.4047770000000004e-10 3.3543400000000003e-10 3.308619e-10 3.2668080000000005e-10 3.228289e-10 3.192582e-10 3.1593049999999997e-10 3.128147e-10 3.098855e-10 3.0712180000000003e-10 3.045058e-10 3.0202270000000004e-10 2.996595e-10 2.974051e-10 2.9525009999999997e-10 2.93186e-10 2.917808e-10 2.903019e-10 2.887411e-10 2.870888e-10 2.853337e-10 2.8346200000000004e-10 2.814572e-10 2.792989e-10 2.7696160000000004e-10 2.7441290000000003e-10 2.7161080000000005e-10 2.684992e-10 2.650011e-10 2.610067e-10 2.563517e-10 2.507734e-10 2.438123e-10 2.3454899999999997e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.755289 1.21683 1.55031 1.81325 2.03288 2.22377 2.39238 2.54193 2.67481 2.79334 2.8998 2.99611 3.08353 3.16259 3.23324 3.29525 3.34845 3.39291 3.42894 3.45703 3.47778 3.49181 3.49975 3.50224 3.5011 3.49743 3.49089 3.48109 3.46758 3.44994 3.42776 3.40076 3.36847 3.32832 3.27728 3.21031 3.11829 2.98463 2.77873 2.44121 1.84456 0.665279 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.2101063777474112e-19 1.9495765774880644e-19 2.483870436992448e-19 2.9051467576656e-19 3.2570328088919042e-19 3.5628723040364163e-19 3.8330153040695044e-19 4.0726208177101437e-19 4.285518047082048e-19 4.475424041945473e-19 4.64599176499584e-19 4.800297395345088e-19 4.9403596755354245e-19 5.067027759175872e-19 5.180221537435392e-19 5.2795725096912e-19 5.364808305917761e-19 5.4360410784785285e-19 5.493767502125952e-19 5.538772643404224e-19 5.572017808285824e-19 5.594496346275648e-19 5.607217628644801e-19 5.611207048430592e-19 5.60938056708288e-19 5.603500578884545e-19 5.593022343784512e-19 5.577321012900673e-19 5.555675606753665e-19 5.527413211162752e-19 5.491876933713409e-19 5.448618164951808e-19 5.396883881866176e-19 5.332556490541057e-19 5.250781395815424e-19 5.143483627520449e-19 4.996051334874432e-19 4.781904407738305e-19 4.452016241515585e-19 3.911249588463168e-19 2.9553109076628483e-19 1.0658944601092032e-19 ] } }