{ "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" [ "Ag" "Ag" "Ag" "Ag" ] } "a" { "source-value" [ 6.135 5.723932 5.469169 5.28407 5.138604 5.018757 4.916842 4.828184 4.749729 4.679368 4.615586 4.557258 4.503524 4.453712 4.40729 4.363824 4.322961 4.284407 4.247914 4.213273 4.180306 4.148858 4.118795 4.09 4.06089 4.030892 3.999949 3.968002 3.934982 3.900814 3.865417 3.828698 3.790554 3.750871 3.709519 3.666352 3.621203 3.573881 3.524166 3.471803 3.416495 3.35789 3.29557 3.229032 3.157663 3.080707 2.997213 2.905968 2.805384 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.135e-10 5.723932e-10 5.469169000000001e-10 5.28407e-10 5.138604e-10 5.018757e-10 4.916842e-10 4.828184e-10 4.749729000000001e-10 4.679368000000001e-10 4.615586000000001e-10 4.5572580000000004e-10 4.503524e-10 4.4537120000000006e-10 4.40729e-10 4.3638240000000004e-10 4.3229610000000005e-10 4.284407e-10 4.2479139999999997e-10 4.213273e-10 4.180306e-10 4.148858e-10 4.118795000000001e-10 4.09e-10 4.06089e-10 4.030892e-10 3.999949e-10 3.968002e-10 3.9349820000000003e-10 3.900814e-10 3.865417e-10 3.8286980000000003e-10 3.790554e-10 3.750871e-10 3.709519e-10 3.666352e-10 3.6212030000000003e-10 3.573881e-10 3.524166e-10 3.4718030000000003e-10 3.416495e-10 3.35789e-10 3.29557e-10 3.2290320000000003e-10 3.157663e-10 3.080707e-10 2.9972130000000003e-10 2.905968e-10 2.805384e-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" [ 0.544056 0.866822 1.13545 1.36209 1.55853 1.73093 1.88337 2.01879 2.13937 2.24681 2.34247 2.42745 2.50267 2.56892 2.62685 2.67705 2.72002 2.75619 2.78597 2.8097 2.82769 2.84024 2.8476 2.85 2.8474 2.83899 2.82367 2.80016 2.76693 2.72211 2.66346 2.58825 2.49314 2.37404 2.22587 2.04229 1.81535 1.53496 1.18818 0.758294 0.223406 -0.445548 -1.2877 -2.35662 -3.7268 -5.50474 -7.84627 -10.983 -15.2781 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 8.716738107875039e-20 1.388801954237148e-19 1.8191914590753e-19 2.18230877140506e-19 2.4970403493880196e-19 2.7732556010896197e-19 3.01749140717658e-19 3.23445816695286e-19 3.42764862548058e-19 3.5997864830375396e-19 3.75305069984598e-19 3.8892036702032997e-19 4.00971939661278e-19 4.1158635986152797e-19 4.2086776910229e-19 4.2891069580496994e-19 4.357952488012679e-19 4.41590321686446e-19 4.46361603702498e-19 4.5016356885498e-19 4.53045884619546e-19 4.55056616295216e-19 4.5623581829784e-19 4.5662034069e-19 4.562037747651599e-19 4.548563442159659e-19 4.52401809612678e-19 4.486350923461439e-19 4.433110593913619e-19 4.361301037177739e-19 4.26733337759364e-19 4.1468336729504996e-19 3.9944506532907594e-19 3.8036314161813594e-19 3.56623690432158e-19 3.27210931785186e-19 2.9085113525318996e-19 2.45927704612464e-19 1.9036742329861198e-19 1.214920928502396e-19 3.57935873095404e-20 -7.138465949254319e-20 -2.0631228516018e-19 -3.7757214992170797e-19 -5.970991879591199e-19 -8.81956580424516e-19 -1.2571110458055178e-18 -1.7596705971222e-18 -2.4478214831915397e-18 ] } }