{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Fe" ] } "a" { "source-value" [ 3.67928 3.432754 3.279967 3.168959 3.08172 3.009845 2.948725 2.895555 2.848503 2.806306 2.768055 2.733075 2.700849 2.670976 2.643136 2.617068 2.592562 2.56944 2.547554 2.52678 2.507008 2.488148 2.470119 2.45285 2.441094 2.428721 2.415663 2.40184 2.387156 2.371497 2.354725 2.336668 2.317113 2.29579 2.272347 2.246314 2.217049 2.183631 2.144687 2.098017 2.039779 1.96228 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.67928e-10 3.432754e-10 3.2799670000000004e-10 3.168959e-10 3.08172e-10 3.009845e-10 2.948725e-10 2.895555e-10 2.848503e-10 2.8063060000000003e-10 2.768055e-10 2.733075e-10 2.7008489999999997e-10 2.670976e-10 2.643136e-10 2.6170680000000003e-10 2.592562e-10 2.5694400000000003e-10 2.547554e-10 2.5267800000000003e-10 2.507008e-10 2.4881479999999997e-10 2.470119e-10 2.4528500000000005e-10 2.441094e-10 2.428721e-10 2.415663e-10 2.4018400000000003e-10 2.387156e-10 2.371497e-10 2.3547250000000004e-10 2.336668e-10 2.317113e-10 2.2957900000000004e-10 2.272347e-10 2.246314e-10 2.2170489999999998e-10 2.1836310000000001e-10 2.1446869999999998e-10 2.0980170000000001e-10 2.0397789999999998e-10 1.96228e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0.14229 0.863048 1.57013 2.03675 2.26046 2.37362 2.47284 2.5601 2.63689 2.70443 2.76368 2.81544 2.86038 2.89907 2.93198 2.95953 2.9821 3 3.01352 3.0229 3.02839 3.03018 3.02931 3.02647 3.02121 3.01295 3.00098 2.98434 2.95861 2.921 2.8709 2.81136 2.74656 2.67815 2.59955 2.48811 2.29429 1.92452 1.23113 -0.0937153 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 2.2797371325185998e-20 1.382755339620432e-19 2.51562559834242e-19 3.2632332592995e-19 3.62165619409164e-19 3.8029585019950794e-19 3.96192646762056e-19 4.1017324007033994e-19 4.22476354442826e-19 4.3329745542886197e-19 4.42790351985312e-19 4.51083218242896e-19 4.58283400036092e-19 4.64482221433038e-19 4.69754984735532e-19 4.74168981362202e-19 4.7778509402514e-19 4.806529901999999e-19 4.82819133009168e-19 4.843219746918599e-19 4.852015696639259e-19 4.8548835928141195e-19 4.85348969914254e-19 4.84893951750198e-19 4.840512068407139e-19 4.8272780894103e-19 4.80810003510132e-19 4.7814398159115595e-19 4.74021581111874e-19 4.679957947914e-19 4.5996888985506e-19 4.50429530176224e-19 4.4004742558790395e-19 4.2908693523471e-19 4.1649382689146995e-19 3.986391704821739e-19 3.6758578296198602e-19 3.08342097566568e-19 1.97248771941642e-19 -1.501484639083002e-20 ] } }