{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0966513 0.3220708 -1.901516 ] [ 1.6847077 1.4460082 -0.6525031 ] [ -0.9545742 -1.2960095 -0.7401851 ] [ -0.4709223 -0.5303711 0.5055197 ] [ 0.9834228 -0.0174034 1.6157073 ] [ -0.7769416 -0.12198 1.3058818 ] [ -0.3690411 0.1976849 -0.1329046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.548524532299271e-10 5.160143060023527e-10 -3.046564479277133e-09 ] [ 2.69919928982174e-09 2.316760531525091e-09 -1.045425211819525e-09 ] [ -1.529396466058863e-09 -2.076436121234698e-09 -1.18590726228451e-09 ] [ -7.545006992733639e-10 -8.497481767679789e-10 8.099318446938298e-10 ] [ 1.575617018521674e-09 -2.788332060243072e-11 2.588648462115892e-09 ] [ -1.244797667246945e-09 -1.95433504205184e-10 2.092253289488222e-09 ] [ -5.91269022534315e-10 3.167261250651859e-10 -2.129366429167757e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.880798 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.66590796208474e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6312026 1.9698153 1.9132242 ] [ 3.2829815 4.8231405 3.9006251 ] [ 1.3448447 3.4846532 3.3090525 ] [ 4.6039344 3.1480485 1.2966985 ] [ 3.2273833 2.2640557 4.23861 ] [ 2.6868101 4.5290317 1.5752176 ] [ 5.1819585 3.433245 3.5510551 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6312026e-10 1.9698153e-10 1.9132242e-10 ] [ 3.2829815e-10 4.8231405e-10 3.9006251e-10 ] [ 1.3448447e-10 3.4846532e-10 3.3090525e-10 ] [ 4.6039344e-10 3.1480485e-10 1.2966985e-10 ] [ 3.2273833e-10 2.2640557e-10 4.238610000000001e-10 ] [ 2.6868101e-10 4.5290317e-10 1.5752176e-10 ] [ 5.1819585e-10 3.433245e-10 3.5510551e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.83e-05 -1.51e-05 -3.73e-05 ] [ 3.77e-05 2.31e-05 -2.7e-06 ] [ -1.19e-05 -3.9e-06 9.4e-06 ] [ -5.5e-06 3.64e-05 1.28e-05 ] [ 8.5e-06 -3.95e-05 2.96e-05 ] [ 2.9e-06 -2.06e-05 -4.37e-05 ] [ 1.66e-05 1.96e-05 3.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.738513078464e-14 -2.419286697408e-14 -5.976118795584e-14 ] [ 6.040205860416e-14 3.701027994048e-14 -4.32587687616e-15 ] [ -1.906590178752e-14 -6.24848882112e-15 1.506046023552e-14 ] [ -8.8119714144e-15 5.831922899712e-14 2.050786074624e-14 ] [ 1.36185012768e-14 -6.32859765216e-14 4.742442797568e-14 ] [ 4.646312200320001e-15 -3.300483838848e-14 -7.001511832895999e-14 ] [ 2.659613190528e-14 3.140266176767999e-14 5.110943420352001e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }