{ "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" [ "U" "U" "U" "U" ] } "a" { "source-value" [ 6.42 5.989836 5.723238 5.52954 5.377317 5.251902 5.145253 5.052477 4.970376 4.896747 4.830002 4.768964 4.712734 4.660609 4.61203 4.566545 4.523783 4.483438 4.44525 4.409 4.374501 4.341592 4.310132 4.28 4.259487 4.237897 4.215112 4.190992 4.16537 4.138047 4.10878 4.077273 4.043152 4.005945 3.965039 3.919614 3.868548 3.810238 3.742283 3.660848 3.559228 3.424 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.420000000000001e-10 5.989836e-10 5.723238e-10 5.52954e-10 5.377317e-10 5.251902000000001e-10 5.145253e-10 5.052477e-10 4.970376e-10 4.896747000000001e-10 4.830002e-10 4.768964000000001e-10 4.712734e-10 4.660609e-10 4.61203e-10 4.5665449999999996e-10 4.523783e-10 4.483438e-10 4.4452499999999997e-10 4.409e-10 4.3745010000000006e-10 4.3415920000000003e-10 4.3101320000000003e-10 4.28e-10 4.259487e-10 4.2378970000000005e-10 4.2151120000000005e-10 4.190992e-10 4.16537e-10 4.1380470000000006e-10 4.1087800000000007e-10 4.077273e-10 4.0431520000000003e-10 4.005945e-10 3.9650390000000003e-10 3.9196140000000004e-10 3.8685480000000004e-10 3.810238e-10 3.7422830000000004e-10 3.660848e-10 3.559228e-10 3.4240000000000003e-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" [ 1.93841 2.52271 2.9442 3.27826 3.55558 3.7921 3.99723 4.17708 4.33585 4.47656 4.60149 4.71237 4.81058 4.89721 4.97317 5.03921 5.09596 5.14395 5.18364 5.21544 5.23968 5.25668 5.26671 5.27 5.26839 5.26307 5.25313 5.23743 5.21446 5.18226 5.13819 5.07865 4.99866 4.89109 4.74555 4.54623 4.26819 3.86987 3.27733 2.34669 0.760608 -2.32789 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.1056752091119395e-19 4.04182701635814e-19 4.717128445822799e-19 5.252351572176839e-19 5.69666719631772e-19 6.0756140137914e-19 6.40426850672382e-19 6.69241997434872e-19 6.946797558528899e-19 7.172239832699039e-19 7.372399759584659e-19 7.55004910476258e-19 7.7073988719877195e-19 7.84619543379114e-19 7.9678967709097785e-19 8.073704515819139e-19 8.164628039798639e-19 8.2415164964643e-19 8.305106887067759e-19 8.35605610402896e-19 8.394892865637119e-19 8.42212986841512e-19 8.438199700054139e-19 8.443470861179999e-19 8.44089135679926e-19 8.432367777106379e-19 8.416442141364419e-19 8.391287968210619e-19 8.354485970927639e-19 8.30289588331284e-19 8.232287959052459e-19 8.136894362264099e-19 8.008736253310439e-19 7.83639011279106e-19 7.603209325478699e-19 7.28386347878982e-19 6.838394287472459e-19 6.20021529061758e-19 5.25086154790722e-19 3.75981188524146e-19 1.218628365233472e-19 -3.7296909645222596e-19 ] } }