{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.9641292e-10 1.2201303e-10 2.1884128e-10 ] [ 1.0747984e-10 2.9401122e-10 2.0359765e-10 ] [ 3.0172856e-10 3.0490386e-10 5.146334e-11 ] [ 1.8689145e-10 2.2077776e-10 4.2803661e-10 ] [ 4.3107916e-10 1.8561052e-10 4.1716615e-10 ] [ 3.3577021e-10 3.7403251e-10 2.8715019e-10 ] ] "source-value" [ [ 2.9641292 1.2201303 2.1884128 ] [ 1.0747984 2.9401122 2.0359765 ] [ 3.0172856 3.0490386 0.5146334 ] [ 1.8689145 2.2077776 4.2803661 ] [ 4.3107916 1.8561052 4.1716615 ] [ 3.3577021 3.7403251 2.8715019 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.72386047302208e-12 4.045816402844161e-12 6.26114601642432e-12 ] [ 4.11711326246976e-12 -1.35255750327936e-12 -1.5549124104864e-12 ] [ 1.47448314412224e-12 -2.18488825778496e-12 2.68396627516416e-12 ] [ 5.9424730865472e-13 -7.6551998941824e-13 -1.73820141590592e-12 ] [ -4.918682225856e-13 -8.517170916172801e-13 -7.99101611390208e-12 ] [ -2.96979458431488e-12 1.10886643925568e-12 2.33885743104384e-12 ] ] "source-value" [ [ -0.0017001 0.0025252 0.0039079 ] [ 0.0025697 -0.0008442 -0.0009705 ] [ 0.0009203 -0.0013637 0.0016752 ] [ 0.0003709 -0.0004778 -0.0010849 ] [ -0.000307 -0.0005316 -0.0049876 ] [ -0.0018536 0.0006921 0.0014598 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.891208942588275e-18 "source-value" -18.045507 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.40945413948615e-09 -5.747452623474858e-09 5.075788941591393e-09 ] [ 3.092513943455704e-09 -7.765173297434113e-11 -1.779801130776682e-09 ] [ -1.374478483805146e-09 5.63134272354782e-09 -3.921439111336132e-09 ] [ -1.293847823839751e-09 1.555060772041486e-09 4.276533841680912e-09 ] [ -1.747179212600573e-09 -4.818837783200985e-10 -3.35056723914356e-09 ] [ -1.086462562696385e-09 -8.794153608200083e-10 -3.005153020159315e-10 ] ] "source-value" [ [ 1.503863 -3.5872778 3.1680583 ] [ 1.9301954 -0.0484664 -1.1108645 ] [ -0.857882 3.5148077 -2.4475698 ] [ -0.8075563 0.9705926 2.6692025 ] [ -1.0905035 -0.3007682 -2.0912596 ] [ -0.6781166 -0.5488879 -0.1875669 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.439694261897778e-18 "source-value" -15.227374 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.924097e-10 1.394529e-10 2.047948e-10 ] [ 8.517503e-11 3.0229e-10 2.150903e-10 ] [ 3.084941000000001e-10 2.892354e-10 5.199401e-11 ] [ 2.119748e-10 2.11188e-10 4.047438e-10 ] [ 4.365389e-10 1.647318e-10 4.564937e-10 ] [ 3.247696e-10 3.944508e-10 2.731386e-10 ] ] "source-value" [ [ 2.924097 1.394529 2.047948 ] [ 0.8517503 3.0229 2.150903 ] [ 3.084941 2.892354 0.5199401 ] [ 2.119748 2.11188 4.047438 ] [ 4.365389 1.647318 4.564937 ] [ 3.247696 3.944508 2.731386 ] ] } "instance-id" 1 }