{ "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" [ "Be" "Be" ] } "a" { "source-value" [ 3.80292 3.54811 3.390189 3.275452 3.185281 3.110991 3.047817 2.99286 2.944228 2.900613 2.861077 2.824921 2.791612 2.760736 2.731959 2.705016 2.679686 2.655788 2.633167 2.611694 2.591258 2.571764 2.553129 2.53528 2.523129 2.51034 2.496843 2.482555 2.467378 2.451193 2.433856 2.415192 2.394981 2.372941 2.34871 2.321802 2.291552 2.257012 2.216758 2.168519 2.108324 2.02822 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.80292e-10 3.54811e-10 3.390189e-10 3.275452e-10 3.185281e-10 3.110991e-10 3.0478170000000003e-10 2.9928599999999997e-10 2.944228e-10 2.900613e-10 2.861077e-10 2.8249209999999997e-10 2.791612e-10 2.760736e-10 2.731959e-10 2.7050160000000004e-10 2.6796859999999997e-10 2.655788e-10 2.633167e-10 2.611694e-10 2.5912579999999997e-10 2.5717640000000003e-10 2.553129e-10 2.5352800000000004e-10 2.523129e-10 2.51034e-10 2.4968430000000004e-10 2.482555e-10 2.4673780000000004e-10 2.451193e-10 2.433856e-10 2.4151919999999996e-10 2.394981e-10 2.3729410000000003e-10 2.34871e-10 2.321802e-10 2.2915519999999998e-10 2.257012e-10 2.216758e-10 2.168519e-10 2.1083240000000003e-10 2.0282200000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.28059 1.69567 1.9853 2.20704 2.38488 2.5315 2.65455 2.75905 2.8485 2.92545 2.99182 3.04911 3.09849 3.14094 3.17722 3.208 3.23382 3.25515 3.27241 3.28593 3.29602 3.30295 3.30696 3.30825 3.30764 3.30562 3.3019 3.29613 3.28782 3.27639 3.26106 3.24079 3.21422 3.17942 3.13372 3.07319 2.99193 2.88058 2.72341 2.49186 2.12798 1.49274 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.0517313757340598e-19 2.71676285297478e-19 3.1808012714802e-19 3.53606791830336e-19 3.8209990108939196e-19 4.0559101489709994e-19 4.2530579837847e-19 4.420485442037699e-19 4.563800141948999e-19 4.6870876339353e-19 4.7934240971338795e-19 4.88521279649574e-19 4.964328278682659e-19 5.03234067679596e-19 5.09046764507748e-19 5.1397826418719995e-19 5.18115084256188e-19 5.2153252701651e-19 5.242978838867939e-19 5.26464026695962e-19 5.28080622919668e-19 5.2919093132703e-19 5.29833404157264e-19 5.3004008494305e-19 5.29942352168376e-19 5.29618712488308e-19 5.290227027804599e-19 5.280982468626419e-19 5.267668380797879e-19 5.24935550187126e-19 5.224794134072039e-19 5.19231801370086e-19 5.14974818053548e-19 5.09399243367228e-19 5.02077296149848e-19 4.92379320984246e-19 4.79360033656362e-19 4.61519796836772e-19 4.36338386680194e-19 3.9923998671992396e-19 3.4093998336193197e-19 2.3916331486371596e-19 ] } }