{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5952494 -3.9193276 -2.4240182 ] [ -8.5113357 -6.7312057 8.9093076 ] [ 0.8837614 11.2422399 -4.5899047 ] [ 6.5972928 -0.738439 -1.7970139 ] [ 0.9738941 3.3858274 1.1675292 ] [ -5.0770956 -2.5444631 6.6285028 ] [ 5.7287324 -0.6946319 -7.8944028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.536946722252277e-10 -6.279455049976175e-09 -3.883705288433699e-09 ] [ -1.36366630703204e-08 -1.07845804023357e-08 1.427428434423576e-08 ] [ 1.415941853445477e-09 1.801205393320493e-08 -7.353838002040038e-09 ] [ 1.057002828473217e-08 -1.183109701686931e-09 -2.87913365783263e-09 ] [ 1.560350358155057e-09 5.42469350234405e-09 1.870587988341327e-09 ] [ -8.134403871886548e-09 -4.076679291308293e-09 1.062003221706734e-08 ] [ 9.178441118099474e-09 -1.112922990241884e-09 -1.264822760133806e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.721856 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.717830701478421e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9325297 1.2186062 1.4735029 ] [ 1.5703858 1.6061431 3.5817053 ] [ 2.8279638 3.5848091 2.6470267 ] [ 5.1716797 2.467038 2.1174545 ] [ 4.5185119 3.126819 4.4648355 ] [ 3.5470972 0.9153338 4.8334636 ] [ 4.7355158 0.0966155 2.8665215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9325297e-10 1.2186062e-10 1.4735029e-10 ] [ 1.5703858e-10 1.6061431e-10 3.5817053e-10 ] [ 2.8279638e-10 3.5848091e-10 2.6470267e-10 ] [ 5.1716797e-10 2.467038e-10 2.1174545e-10 ] [ 4.5185119e-10 3.126819e-10 4.4648355e-10 ] [ 3.5470972e-10 9.153338e-11 4.8334636e-10 ] [ 4.7355158e-10 9.661550000000002e-12 2.866521500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -1.3e-06 1.21e-05 ] [ 1.23e-05 -1.45e-05 -2.63e-05 ] [ 9.4e-06 2.2e-06 1.11e-05 ] [ -2.39e-05 -6.6e-06 4.5e-06 ] [ 1.9e-05 2.42e-05 -1.7e-06 ] [ -9.2e-06 -6.8e-06 4.1e-06 ] [ -7e-06 2.9e-06 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -2.08282960704e-15 1.938633711168e-14 ] [ 1.970677243584e-14 -2.32315610016e-14 -4.213724512704e-14 ] [ 1.506046023552e-14 3.52478856576e-15 1.778416049088e-14 ] [ -3.829202123712e-14 -1.057436569728e-14 7.2097947936e-15 ] [ 3.04413557952e-14 3.877267422336e-14 -2.72370025536e-15 ] [ -1.474002491136e-14 -1.089480102144e-14 6.568924145279999e-15 ] [ -1.12152363456e-14 4.646312200320001e-15 -5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.815392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.854340455278736e-18 } }