{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8464849 -4.5878506 -3.8062177 ] [ -9.96077 -6.588493 4.8591192 ] [ -4.1299351 7.9321436 -8.4723097 ] [ 3.9815147 -0.3293404 -3.6965997 ] [ 6.6720364 -10.0442027 5.8848629 ] [ 5.5850336 7.4131712 -0.6777419 ] [ 7.6986053 6.2045719 5.908887 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.577580803381382e-08 -7.350547031602881e-09 -6.098233062857221e-09 ] [ -1.595891295064818e-08 -1.055592953787256e-08 7.785167244060772e-09 ] [ -6.616885517156453e-09 1.270869513345264e-08 -1.357413663735155e-08 ] [ 6.379089820267519e-09 -5.276614935122135e-10 -5.922605664591409e-09 ] [ 1.068978082127748e-08 -1.609258687309971e-08 9.428589832673477e-09 ] [ 8.948210334024903e-09 1.187720968048174e-08 -1.085862236062765e-09 ] [ 1.233452552604856e-08 9.940820122152984e-09 9.467080684346357e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.561288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.051234232254459e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1888267 2.5529225 1.2879443 ] [ 1.7844341 2.2206912 4.2992395 ] [ 2.3191646 4.407426 3.0614255 ] [ 4.5664293 2.1333691 1.8789987 ] [ 4.2447708 1.8689873 4.2730477 ] [ 4.5669969 4.618483 1.8355989 ] [ 4.1627465 4.2860849 4.8468933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1888267e-10 2.5529225e-10 1.2879443e-10 ] [ 1.7844341e-10 2.2206912e-10 4.2992395e-10 ] [ 2.3191646e-10 4.407426e-10 3.0614255e-10 ] [ 4.566429300000001e-10 2.1333691e-10 1.8789987e-10 ] [ 4.2447708e-10 1.8689873e-10 4.2730477e-10 ] [ 4.566996900000001e-10 4.618483e-10 1.8355989e-10 ] [ 4.1627465e-10 4.2860849e-10 4.8468933e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.25e-05 1.77e-05 1.15e-05 ] [ -2.35e-05 -1.91e-05 2.05e-05 ] [ 2.14e-05 1.14e-05 1.2e-06 ] [ 2.94e-05 2.1e-05 -8.3e-06 ] [ 7.7e-06 -1.82e-05 1.62e-05 ] [ 5.9e-06 -9.6e-06 -3.68e-05 ] [ -2.85e-05 -3.1e-06 -4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0027207925e-14 2.83585264218e-14 1.8425031291e-14 ] [ -3.765115089899999e-14 -3.06015737094e-14 3.2844620997e-14 ] [ 3.42865799676e-14 1.82648136276e-14 1.9226119608e-15 ] [ 4.710399303959999e-14 3.364570931399999e-14 -1.32980660622e-14 ] [ 1.23367600818e-14 -2.915961473879999e-14 2.59552614708e-14 ] [ 9.452842140600001e-15 -1.53808956864e-14 -5.896010013119999e-14 ] [ -4.5662034069e-14 -4.9667475654e-15 -6.8893595262e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.807478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.853072516206905e-18 } }